butyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylate

Systemtic Name: butyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylate Openeye Name: butyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylic acid butyl ester IUPAC Name: butyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-5-carboxylic acid butyl ester Formula: C28H34N2O2 MolecularWeight: 430.58176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C28H34N2O2/c1-2-3-17-32-28(31)23-13-14-27-26(19-23)24(20-30-27)11-7-8-12-25-18-22(15-16-29-25)21-9-5-4-6-10-21/h4-6,9-10,13-15,19-20,25,29-30H,2-3,7-8,11-12,16-18H2,1H3