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

Systemtic Name: 4-azanyl-2-chloranyl-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitro-benzamide Openeye Name: 4-amino-2-chloro-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]-4-piperidyl]-5-nitro-benzamide CAS Name: 4-amino-2-chloro-N-[1-[(4-methyl-1-cyclohexa-1,4-dienyl)methyl]-4-piperidinyl]-5-nitrobenzamide IUPAC Name: 4-amino-2-chloro-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitrobenzamide Traditional Name: 4-amino-2-chloro-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]-4-piperidyl]-5-nitro-benzamide Formula: C20H25ClN4O3 MolecularWeight: 404.8905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(=CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3Cl)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CCC(=CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C20H25ClN4O3/c1-13-2-4-14(5-3-13)12-24-8-6-15(7-9-24)23-20(26)16-10-19(25(27)28)18(22)11-17(16)21/h2,5,10-11,15H,3-4,6-9,12,22H2,1H3,(H,23,26)