2-[2-[4-(1-butylindol-3-yl)piperidin-1-yl]ethoxy]-4-methoxy-benzoic acid

Systemtic Name: 2-[2-[4-(1-butylindol-3-yl)piperidin-1-yl]ethoxy]-4-methoxy-benzoic acid Openeye Name: 2-[2-[4-(1-butylindol-3-yl)-1-piperidyl]ethoxy]-4-methoxy-benzoic acid CAS Name: 2-[2-[4-(1-butyl-3-indolyl)-1-piperidinyl]ethoxy]-4-methoxybenzoic acid IUPAC Name: 2-[2-[4-(1-butylindol-3-yl)piperidin-1-yl]ethoxy]-4-methoxybenzoic acid Traditional Name: 2-[2-[4-(1-butylindol-3-yl)piperidino]ethoxy]-4-methoxy-benzoic acid Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCOC4=C(C=CC(=C4)OC)C(=O)O

Isomeric SMILES

CCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCOC4=C(C=CC(=C4)OC)C(=O)O

InChI

InChI=1S/C27H34N2O4/c1-3-4-13-29-19-24(22-7-5-6-8-25(22)29)20-11-14-28(15-12-20)16-17-33-26-18-21(32-2)9-10-23(26)27(30)31/h5-10,18-20H,3-4,11-17H2,1-2H3,(H,30,31)