4-azanyl-2-methoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(=CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CCC(=CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)[N+](=O)[O-]

InChI

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