N-[[3-methoxy-4-(2-methylpropoxy)phenyl]-[(4-nitrophenyl)carbonylamino]methyl]-4-nitro-benzamide

Systemtic Name: N-[[3-methoxy-4-(2-methylpropoxy)phenyl]-[(4-nitrophenyl)carbonylamino]methyl]-4-nitro-benzamide Openeye Name: N-[(4-isobutoxy-3-methoxy-phenyl)-[(4-nitrobenzoyl)amino]methyl]-4-nitro-benzamide CAS Name: N-[[3-methoxy-4-(2-methylpropoxy)phenyl]-[[(4-nitrophenyl)-oxomethyl]amino]methyl]-4-nitrobenzamide IUPAC Name: N-[[3-methoxy-4-(2-methylpropoxy)phenyl]-[(4-nitrobenzoyl)amino]methyl]-4-nitrobenzamide Traditional Name: N-[(4-isobutoxy-3-methoxy-phenyl)-[(4-nitrobenzoyl)amino]methyl]-4-nitro-benzamide Formula: C26H26N4O8 MolecularWeight: 522.50664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C26H26N4O8/c1-16(2)15-38-22-13-8-19(14-23(22)37-3)24(27-25(31)17-4-9-20(10-5-17)29(33)34)28-26(32)18-6-11-21(12-7-18)30(35)36/h4-14,16,24H,15H2,1-3H3,(H,27,31)(H,28,32)