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

Systemtic Name: methyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-6-carboxylate Openeye Name: methyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-6-carboxylate CAS Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-6-carboxylate Traditional Name: 3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-6-carboxylic acid methyl ester Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=CN2)CCCCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2/c1-29-25(28)20-11-12-23-21(17-27-24(23)16-20)9-5-6-10-22-15-19(13-14-26-22)18-7-3-2-4-8-18/h2-4,7-8,11-13,16-17,22,26-27H,5-6,9-10,14-15H2,1H3