4-(3-methylpiperidin-1-yl)-3-nitro-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)-3-nitro-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-3-nitro-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidyl]benzamide CAS Name: 4-(3-methyl-1-piperidinyl)-3-nitro-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidinyl]benzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)-3-nitro-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[2-keto-2-(propylamino)ethyl]-4-piperidyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C23H35N5O4 MolecularWeight: 445.5551

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCCC(C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCCC(C3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H35N5O4/c1-3-10-24-22(29)16-26-12-8-19(9-13-26)25-23(30)18-6-7-20(21(14-18)28(31)32)27-11-4-5-17(2)15-27/h6-7,14,17,19H,3-5,8-13,15-16H2,1-2H3,(H,24,29)(H,25,30)