1-[(3-chlorophenyl)methyl]-3-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-2-methyl-indole

Systemtic Name: 1-[(3-chlorophenyl)methyl]-3-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-2-methyl-indole Openeye Name: 1-[(3-chlorophenyl)methyl]-3-[1-(4-ethoxyphenyl)sulfonyl-4-piperidyl]-2-methyl-indole CAS Name: 1-[(3-chlorophenyl)methyl]-3-[1-(4-ethoxyphenyl)sulfonyl-4-piperidinyl]-2-methylindole IUPAC Name: 1-[(3-chlorophenyl)methyl]-3-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-2-methylindole Traditional Name: 1-(3-chlorobenzyl)-2-methyl-3-(1-p-phenetylsulfonyl-4-piperidyl)indole Formula: C29H31ClN2O3S MolecularWeight: 523.08604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=CC(=CC=C5)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=CC(=CC=C5)Cl)C

InChI

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