[2-phenyl-1-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-3H-inden-5-yl] methanesulfonate

Systemtic Name: [2-phenyl-1-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-3H-inden-5-yl] methanesulfonate Openeye Name: [2-phenyl-1-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-3H-inden-5-yl] methanesulfonate CAS Name: methanesulfonic acid [2-phenyl-1-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-3H-inden-5-yl] ester IUPAC Name: [2-phenyl-1-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-3H-inden-5-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-phenyl-1-[4-(2-pyrrolidinoethoxy)benzyl]-3H-inden-5-yl] ester Formula: C29H31NO4S MolecularWeight: 489.62574

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(C2)C3=CC=CC=C3)CC4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(C2)C3=CC=CC=C3)CC4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C29H31NO4S/c1-35(31,32)34-26-13-14-27-24(20-26)21-28(23-7-3-2-4-8-23)29(27)19-22-9-11-25(12-10-22)33-18-17-30-15-5-6-16-30/h2-4,7-14,20H,5-6,15-19,21H2,1H3