2-(4-methylpiperidin-1-yl)-N-[2-(2-methylpropanoylamino)ethyl]-5-nitro-benzamide

Systemtic Name: 2-(4-methylpiperidin-1-yl)-N-[2-(2-methylpropanoylamino)ethyl]-5-nitro-benzamide Openeye Name: 2-(4-methyl-1-piperidyl)-N-[2-(2-methylpropanoylamino)ethyl]-5-nitro-benzamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: 2-(4-methylpiperidin-1-yl)-N-[2-(2-methylpropanoylamino)ethyl]-5-nitrobenzamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C19H28N4O4 MolecularWeight: 376.45002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCNC(=O)C(C)C

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCNC(=O)C(C)C

InChI

InChI=1S/C19H28N4O4/c1-13(2)18(24)20-8-9-21-19(25)16-12-15(23(26)27)4-5-17(16)22-10-6-14(3)7-11-22/h4-5,12-14H,6-11H2,1-3H3,(H,20,24)(H,21,25)