ethyl 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylate; 3-(1-methylpiperidin-4-yl)-1H-indole-5-carboxylic acid

Systemtic Name: ethyl 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylate; 3-(1-methylpiperidin-4-yl)-1H-indole-5-carboxylic acid Openeye Name: ethyl 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylate; 3-(1-methyl-4-piperidyl)-1H-indole-5-carboxylic acid CAS Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylic acid ethyl ester; 3-(1-methyl-4-piperidinyl)-1H-indole-5-carboxylic acid IUPAC Name: ethyl 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylate; 3-(1-methylpiperidin-4-yl)-1H-indole-5-carboxylic acid Traditional Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-5-carboxylic acid ethyl ester; 3-(1-methyl-4-piperidyl)-1H-indole-5-carboxylic acid Formula: C32H38N4O4 MolecularWeight: 542.66852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC=C2C3=CCN(CC3)C.CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC=C2C3=CCN(CC3)C.CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)C(=O)O

InChI

InChI=1S/C17H20N2O2.C15H18N2O2/c1-3-21-17(20)13-4-5-16-14(10-13)15(11-18-16)12-6-8-19(2)9-7-12;1-17-6-4-10(5-7-17)13-9-16-14-3-2-11(15(18)19)8-12(13)14/h4-6,10-11,18H,3,7-9H2,1-2H3;2-3,8-10,16H,4-7H2,1H3,(H,18,19)