N-[(4-heptoxy-3-methoxy-phenyl)-[(3-nitrophenyl)carbonylamino]methyl]-3-nitro-benzamide

Systemtic Name: N-[(4-heptoxy-3-methoxy-phenyl)-[(3-nitrophenyl)carbonylamino]methyl]-3-nitro-benzamide Openeye Name: N-[(4-heptoxy-3-methoxy-phenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitro-benzamide CAS Name: N-[(4-heptoxy-3-methoxyphenyl)-[[(3-nitrophenyl)-oxomethyl]amino]methyl]-3-nitrobenzamide IUPAC Name: N-[(4-heptoxy-3-methoxyphenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitrobenzamide Traditional Name: N-[(4-heptoxy-3-methoxy-phenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitro-benzamide Formula: C29H32N4O8 MolecularWeight: 564.58638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)C(NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)C(NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C29H32N4O8/c1-3-4-5-6-7-16-41-25-15-14-20(19-26(25)40-2)27(30-28(34)21-10-8-12-23(17-21)32(36)37)31-29(35)22-11-9-13-24(18-22)33(38)39/h8-15,17-19,27H,3-7,16H2,1-2H3,(H,30,34)(H,31,35)