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

Systemtic Name: N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-N-methyl-5-methylsulfonyl-benzamide Openeye Name: N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-2-methoxy-N-methyl-5-methylsulfonyl-benzamide CAS Name: N-[1-(1-cyclohexa-1,3-dienylmethyl)-4-piperidinyl]-2-methoxy-N-methyl-5-methylsulfonylbenzamide IUPAC Name: N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-N-methyl-5-methylsulfonylbenzamide Traditional Name: N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-5-mesyl-2-methoxy-N-methyl-benzamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CC2=CC=CCC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC

Isomeric SMILES

CN(C1CCN(CC1)CC2=CC=CCC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C22H30N2O4S/c1-23(18-11-13-24(14-12-18)16-17-7-5-4-6-8-17)22(25)20-15-19(29(3,26)27)9-10-21(20)28-2/h4-5,7,9-10,15,18H,6,8,11-14,16H2,1-3H3