2-chloranyl-4-nitro-N-[3-[(4-nitrophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[3-[(4-nitrophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxy-anilino]propyl]benzamide CAS Name: 2-chloro-4-nitro-N-[3-(N-[(4-nitroanilino)-oxomethyl]-4-phenoxyanilino)propyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxyanilino]propyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[3-[N-[(4-nitrophenyl)carbamoyl]-4-phenoxy-anilino]propyl]benzamide Formula: C29H24ClN5O7 MolecularWeight: 589.98316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H24ClN5O7/c30-27-19-23(35(40)41)13-16-26(27)28(36)31-17-4-18-33(29(37)32-20-7-9-22(10-8-20)34(38)39)21-11-14-25(15-12-21)42-24-5-2-1-3-6-24/h1-3,5-16,19H,4,17-18H2,(H,31,36)(H,32,37)