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

Systemtic Name: 5-chloranyl-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-benzamide Openeye Name: 5-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-2-methoxy-benzamide CAS Name: 5-chloro-N-[1-(1-cyclohexa-1,3-dienylmethyl)-4-piperidinyl]-2-methoxybenzamide IUPAC Name: 5-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxybenzamide Traditional Name: 5-chloro-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-2-methoxy-benzamide Formula: C20H25ClN2O2 MolecularWeight: 360.8777

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NC2CCN(CC2)CC3=CC=CCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NC2CCN(CC2)CC3=CC=CCC3

InChI

InChI=1S/C20H25ClN2O2/c1-25-19-8-7-16(21)13-18(19)20(24)22-17-9-11-23(12-10-17)14-15-5-3-2-4-6-15/h2-3,5,7-8,13,17H,4,6,9-12,14H2,1H3,(H,22,24)