methyl 7-chloranyl-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate

Systemtic Name: methyl 7-chloranyl-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate Openeye Name: methyl 7-chloro-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate CAS Name: 7-chloro-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylic acid methyl ester IUPAC Name: methyl 7-chloro-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate Traditional Name: 7-chloro-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylic acid methyl ester Formula: C25H27ClN2O2 MolecularWeight: 422.94708

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CNC2=C(C=C1)Cl)CCCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2C(=CNC2=C(C=C1)Cl)CCCCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C25H27ClN2O2/c1-30-25(29)21-11-12-22(26)24-23(21)19(16-28-24)9-5-6-10-20-15-18(13-14-27-20)17-7-3-2-4-8-17/h2-4,7-8,11-13,16,20,27-28H,5-6,9-10,14-15H2,1H3