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

Systemtic Name: 4-azanyl-2-chloranyl-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-5-nitro-benzamide Openeye Name: 4-amino-2-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-5-nitro-benzamide CAS Name: 4-amino-2-chloro-N-[1-(1-cyclohexa-1,3-dienylmethyl)-4-piperidinyl]-5-nitrobenzamide IUPAC Name: 4-amino-2-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-5-nitrobenzamide Traditional Name: 4-amino-2-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-5-nitro-benzamide Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3Cl)N)[N+](=O)[O-]

Isomeric SMILES

C1CC(=CC=C1)CN2CCC(CC2)NC(=O)C3=CC(=C(C=C3Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C19H23ClN4O3/c20-16-11-17(21)18(24(26)27)10-15(16)19(25)22-14-6-8-23(9-7-14)12-13-4-2-1-3-5-13/h1-2,4,10-11,14H,3,5-9,12,21H2,(H,22,25)