3-[1-(3-chloranyl-4-methoxy-phenyl)sulfonylpiperidin-4-yl]-2-methyl-1-[(2-methylphenyl)methyl]indole

Systemtic Name: 3-[1-(3-chloranyl-4-methoxy-phenyl)sulfonylpiperidin-4-yl]-2-methyl-1-[(2-methylphenyl)methyl]indole Openeye Name: 3-[1-(3-chloro-4-methoxy-phenyl)sulfonyl-4-piperidyl]-2-methyl-1-(o-tolylmethyl)indole CAS Name: 3-[1-(3-chloro-4-methoxyphenyl)sulfonyl-4-piperidinyl]-2-methyl-1-[(2-methylphenyl)methyl]indole IUPAC Name: 3-[1-(3-chloro-4-methoxyphenyl)sulfonylpiperidin-4-yl]-2-methyl-1-[(2-methylphenyl)methyl]indole Traditional Name: 3-[1-(3-chloro-4-methoxy-phenyl)sulfonyl-4-piperidyl]-2-methyl-1-(2-methylbenzyl)indole Formula: C29H31ClN2O3S MolecularWeight: 523.08604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C3=CC=CC=C32)C4CCN(CC4)S(=O)(=O)C5=CC(=C(C=C5)OC)Cl)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C3=CC=CC=C32)C4CCN(CC4)S(=O)(=O)C5=CC(=C(C=C5)OC)Cl)C

InChI

InChI=1S/C29H31ClN2O3S/c1-20-8-4-5-9-23(20)19-32-21(2)29(25-10-6-7-11-27(25)32)22-14-16-31(17-15-22)36(33,34)24-12-13-28(35-3)26(30)18-24/h4-13,18,22H,14-17,19H2,1-3H3