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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N1)CCCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N1)CCCCC3CC(=CCN3)C4=CC=CC=C4

InChI

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