4-(cyclopropylamino)-3-nitro-N-[1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide Openeye Name: 4-(cyclopropylamino)-N-[1-methyl-2-oxo-2-(propylamino)ethyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide Traditional Name: 4-(cyclopropylamino)-N-[2-keto-1-methyl-2-(propylamino)ethyl]-3-nitro-benzamide Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C(C)NC(=O)C1=CC(=C(C=C1)NC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4/c1-3-8-17-15(21)10(2)18-16(22)11-4-7-13(19-12-5-6-12)14(9-11)20(23)24/h4,7,9-10,12,19H,3,5-6,8H2,1-2H3,(H,17,21)(H,18,22)