2-[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]ethyl benzenesulfinate

Systemtic Name: 2-[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]ethyl benzenesulfinate Openeye Name: 2-[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]ethyl benzenesulfinate CAS Name: benzenesulfinic acid 2-[3-[(1-methyl-2-pyrrolidinyl)methyl]-1H-indol-5-yl]ethyl ester IUPAC Name: 2-[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]ethyl benzenesulfinate Traditional Name: benzenesulfinic acid 2-[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]ethyl ester Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CC2=CNC3=C2C=C(C=C3)CCOS(=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCCC1CC2=CNC3=C2C=C(C=C3)CCOS(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O2S/c1-24-12-5-6-19(24)15-18-16-23-22-10-9-17(14-21(18)22)11-13-26-27(25)20-7-3-2-4-8-20/h2-4,7-10,14,16,19,23H,5-6,11-13,15H2,1H3