2-(4-methoxyphenyl)-N-methyl-N-[5-nitro-2-[4-oxidanyl-3-[(2-tetradecoxyphenyl)carbamoyl]naphthalen-1-yl]oxy-phenyl]-5-oxidanylidene-pyrazolidine-1-carboxamide

Systemtic Name: 2-(4-methoxyphenyl)-N-methyl-N-[5-nitro-2-[4-oxidanyl-3-[(2-tetradecoxyphenyl)carbamoyl]naphthalen-1-yl]oxy-phenyl]-5-oxidanylidene-pyrazolidine-1-carboxamide Openeye Name: N-[2-[[4-hydroxy-3-[(2-tetradecoxyphenyl)carbamoyl]-1-naphthyl]oxy]-5-nitro-phenyl]-2-(4-methoxyphenyl)-N-methyl-5-oxo-pyrazolidine-1-carboxamide CAS Name: N-[2-[[4-hydroxy-3-[oxo-(2-tetradecoxyanilino)methyl]-1-naphthalenyl]oxy]-5-nitrophenyl]-2-(4-methoxyphenyl)-N-methyl-5-oxo-1-pyrazolidinecarboxamide IUPAC Name: N-[2-[4-hydroxy-3-[(2-tetradecoxyphenyl)carbamoyl]naphthalen-1-yl]oxy-5-nitrophenyl]-2-(4-methoxyphenyl)-N-methyl-5-oxopyrazolidine-1-carboxamide Traditional Name: N-[2-[4-hydroxy-3-[(2-myristyloxyphenyl)carbamoyl]-1-naphthoxy]-5-nitro-phenyl]-5-keto-2-(4-methoxyphenyl)-N-methyl-pyrazolidine-1-carboxamide Formula: C49H57N5O9 MolecularWeight: 860.00498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=C(C=C(C=C4)[N+](=O)[O-])N(C)C(=O)N5C(=O)CCN5C6=CC=C(C=C6)OC)O

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=C(C=C(C=C4)[N+](=O)[O-])N(C)C(=O)N5C(=O)CCN5C6=CC=C(C=C6)OC)O

InChI

InChI=1S/C49H57N5O9/c1-4-5-6-7-8-9-10-11-12-13-14-19-32-62-43-23-18-17-22-41(43)50-48(57)40-34-45(38-20-15-16-21-39(38)47(40)56)63-44-29-26-36(54(59)60)33-42(44)51(2)49(58)53-46(55)30-31-52(53)35-24-27-37(61-3)28-25-35/h15-18,20-29,33-34,56H,4-14,19,30-32H2,1-3H3,(H,50,57)