[4-[6-oxidanyl-3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1H-inden-2-yl]phenyl] benzoate

Systemtic Name: [4-[6-oxidanyl-3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1H-inden-2-yl]phenyl] benzoate Openeye Name: [4-[6-hydroxy-3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1H-inden-2-yl]phenyl] benzoate CAS Name: benzoic acid [4-[6-hydroxy-3-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1H-inden-2-yl]phenyl] ester IUPAC Name: [4-[6-hydroxy-3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1H-inden-2-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[6-hydroxy-3-[4-(2-pyrrolidinoethoxy)benzyl]-1H-inden-2-yl]phenyl] ester Formula: C35H33NO4 MolecularWeight: 531.64082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(CC4=C3C=CC(=C4)O)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(CC4=C3C=CC(=C4)O)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6

InChI

InChI=1S/C35H33NO4/c37-29-12-17-32-28(23-29)24-33(26-10-15-31(16-11-26)40-35(38)27-6-2-1-3-7-27)34(32)22-25-8-13-30(14-9-25)39-21-20-36-18-4-5-19-36/h1-3,6-17,23,37H,4-5,18-22,24H2