4-(cyclopropylamino)-N-[2-(2-methylpropanoylamino)ethyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[2-(2-methylpropanoylamino)ethyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[2-(2-methylpropanoylamino)ethyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[2-(2-methylpropanoylamino)ethyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[2-(isobutyrylamino)ethyl]-3-nitro-benzamide Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O4/c1-10(2)15(21)17-7-8-18-16(22)11-3-6-13(19-12-4-5-12)14(9-11)20(23)24/h3,6,9-10,12,19H,4-5,7-8H2,1-2H3,(H,17,21)(H,18,22)