N-[(4-butoxyphenyl)-[(3-nitrophenyl)carbonylamino]methyl]-3-nitro-benzamide

Systemtic Name: N-[(4-butoxyphenyl)-[(3-nitrophenyl)carbonylamino]methyl]-3-nitro-benzamide Openeye Name: N-[(4-butoxyphenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitro-benzamide CAS Name: N-[(4-butoxyphenyl)-[[(3-nitrophenyl)-oxomethyl]amino]methyl]-3-nitrobenzamide IUPAC Name: N-[(4-butoxyphenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitrobenzamide Traditional Name: N-[(4-butoxyphenyl)-[(3-nitrobenzoyl)amino]methyl]-3-nitro-benzamide Formula: C25H24N4O7 MolecularWeight: 492.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O7/c1-2-3-14-36-22-12-10-17(11-13-22)23(26-24(30)18-6-4-8-20(15-18)28(32)33)27-25(31)19-7-5-9-21(16-19)29(34)35/h4-13,15-16,23H,2-3,14H2,1H3,(H,26,30)(H,27,31)