N-[3-[(4-nitrophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]-4-pentyl-benzamide

Systemtic Name: N-[3-[(4-nitrophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]-4-pentyl-benzamide Openeye Name: N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxy-anilino]propyl]-4-pentyl-benzamide CAS Name: N-[3-(N-[(4-nitroanilino)-oxomethyl]-4-phenoxyanilino)propyl]-4-pentylbenzamide IUPAC Name: N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxyanilino]propyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxy-anilino]propyl]benzamide Formula: C34H36N4O5 MolecularWeight: 580.67344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NCCCN(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C34H36N4O5/c1-2-3-5-9-26-12-14-27(15-13-26)33(39)35-24-8-25-37(34(40)36-28-16-18-30(19-17-28)38(41)42)29-20-22-32(23-21-29)43-31-10-6-4-7-11-31/h4,6-7,10-23H,2-3,5,8-9,24-25H2,1H3,(H,35,39)(H,36,40)