(2-methylphenyl) N-[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)piperidin-4-yl]carbonylsulfamate

Systemtic Name: (2-methylphenyl) N-[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)piperidin-4-yl]carbonylsulfamate Openeye Name: o-tolyl N-[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)piperidine-4-carbonyl]sulfamate CAS Name: N-[[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)-4-piperidinyl]-oxomethyl]sulfamic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) N-[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)piperidine-4-carbonyl]sulfamate Traditional Name: N-[1-(2-methoxyphenyl)-4-(3-methoxyphenyl)isonipecotoyl]sulfamic acid o-tolyl ester Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OS(=O)(=O)NC(=O)C2(CCN(CC2)C3=CC=CC=C3OC)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=CC=C1OS(=O)(=O)NC(=O)C2(CCN(CC2)C3=CC=CC=C3OC)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H30N2O6S/c1-20-9-4-6-13-24(20)35-36(31,32)28-26(30)27(21-10-8-11-22(19-21)33-2)15-17-29(18-16-27)23-12-5-7-14-25(23)34-3/h4-14,19H,15-18H2,1-3H3,(H,28,30)