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

Systemtic Name: N-(4-azanylcyclohexyl)-3-methyl-4-[(4-nitrophenyl)carbonylamino]benzamide Openeye Name: N-(4-aminocyclohexyl)-3-methyl-4-[(4-nitrobenzoyl)amino]benzamide CAS Name: N-(4-aminocyclohexyl)-3-methyl-4-[[(4-nitrophenyl)-oxomethyl]amino]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-methyl-4-[(4-nitrobenzoyl)amino]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-methyl-4-[(4-nitrobenzoyl)amino]benzamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4/c1-13-12-15(21(27)23-17-7-5-16(22)6-8-17)4-11-19(13)24-20(26)14-2-9-18(10-3-14)25(28)29/h2-4,9-12,16-17H,5-8,22H2,1H3,(H,23,27)(H,24,26)