2-methoxy-4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]indol-1-yl]methyl]benzoic acid

Systemtic Name: 2-methoxy-4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]indol-1-yl]methyl]benzoic acid Openeye Name: 2-methoxy-4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]indol-1-yl]methyl]benzoic acid CAS Name: 2-methoxy-4-[[2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-indolyl]methyl]benzoic acid IUPAC Name: 2-methoxy-4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]indol-1-yl]methyl]benzoic acid Traditional Name: 2-methoxy-4-[[2-[4-(2-pyrrolidinoethoxy)phenyl]indol-1-yl]methyl]benzoic acid Formula: C29H30N2O4 MolecularWeight: 470.5595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C3=CC=CC=C3C=C2C4=CC=C(C=C4)OCCN5CCCC5)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C3=CC=CC=C3C=C2C4=CC=C(C=C4)OCCN5CCCC5)C(=O)O

InChI

InChI=1S/C29H30N2O4/c1-34-28-18-21(8-13-25(28)29(32)33)20-31-26-7-3-2-6-23(26)19-27(31)22-9-11-24(12-10-22)35-17-16-30-14-4-5-15-30/h2-3,6-13,18-19H,4-5,14-17,20H2,1H3,(H,32,33)