4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid CAS Name: 4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid IUPAC Name: 4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-(5-methoxy-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzoic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C3=CCN(CC3)CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C3=CCN(CC3)CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H22N2O3/c1-27-18-6-7-21-19(12-18)20(13-23-21)16-8-10-24(11-9-16)14-15-2-4-17(5-3-15)22(25)26/h2-8,12-13,23H,9-11,14H2,1H3,(H,25,26)