ethyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate

Systemtic Name: ethyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate Openeye Name: ethyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate CAS Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate Traditional Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylic acid ethyl ester Formula: C26H30N2O2 MolecularWeight: 402.5286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)NC=C2CCCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)NC=C2CCCCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O2/c1-2-30-26(29)23-13-8-14-24-25(23)21(18-28-24)11-6-7-12-22-17-20(15-16-27-22)19-9-4-3-5-10-19/h3-5,8-10,13-15,18,22,27-28H,2,6-7,11-12,16-17H2,1H3