4-azanyl-N-[1-(1-cyclohexa-1,3-dien-1-ylethyl)piperidin-4-yl]-2-methoxy-5-nitro-benzamide

Systemtic Name: 4-azanyl-N-[1-(1-cyclohexa-1,3-dien-1-ylethyl)piperidin-4-yl]-2-methoxy-5-nitro-benzamide Openeye Name: 4-amino-N-[1-(1-cyclohexa-1,3-dien-1-ylethyl)-4-piperidyl]-2-methoxy-5-nitro-benzamide CAS Name: 4-amino-N-[1-[1-(1-cyclohexa-1,3-dienyl)ethyl]-4-piperidinyl]-2-methoxy-5-nitrobenzamide IUPAC Name: 4-amino-N-[1-(1-cyclohexa-1,3-dien-1-ylethyl)piperidin-4-yl]-2-methoxy-5-nitrobenzamide Traditional Name: 4-amino-N-[1-(1-cyclohexa-1,3-dien-1-ylethyl)-4-piperidyl]-2-methoxy-5-nitro-benzamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CCC1)N2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CCC1)N2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O4/c1-14(15-6-4-3-5-7-15)24-10-8-16(9-11-24)23-21(26)17-12-19(25(27)28)18(22)13-20(17)29-2/h3-4,6,12-14,16H,5,7-11,22H2,1-2H3,(H,23,26)