2-[2-[4-[1-(2-ethoxyethyl)-7-methyl-indol-3-yl]piperidin-1-yl]ethoxy]benzoic acid

Systemtic Name: 2-[2-[4-[1-(2-ethoxyethyl)-7-methyl-indol-3-yl]piperidin-1-yl]ethoxy]benzoic acid Openeye Name: 2-[2-[4-[1-(2-ethoxyethyl)-7-methyl-indol-3-yl]-1-piperidyl]ethoxy]benzoic acid CAS Name: 2-[2-[4-[1-(2-ethoxyethyl)-7-methyl-3-indolyl]-1-piperidinyl]ethoxy]benzoic acid IUPAC Name: 2-[2-[4-[1-(2-ethoxyethyl)-7-methylindol-3-yl]piperidin-1-yl]ethoxy]benzoic acid Traditional Name: 2-[2-[4-[1-(2-ethoxyethyl)-7-methyl-indol-3-yl]piperidino]ethoxy]benzoic acid Formula: C27H34N2O4 MolecularWeight: 450.56986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=C1C(=CC=C2)C)C3CCN(CC3)CCOC4=CC=CC=C4C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=C1C(=CC=C2)C)C3CCN(CC3)CCOC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H34N2O4/c1-3-32-17-16-29-19-24(22-9-6-7-20(2)26(22)29)21-11-13-28(14-12-21)15-18-33-25-10-5-4-8-23(25)27(30)31/h4-10,19,21H,3,11-18H2,1-2H3,(H,30,31)