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

Systemtic Name: ethyl 7-chloranyl-3-[4-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indole-4-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C26H29ClN2O2 MolecularWeight: 436.97366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29ClN2O2/c1-2-31-26(30)22-12-13-23(27)25-24(22)20(17-29-25)10-6-7-11-21-16-19(14-15-28-21)18-8-4-3-5-9-18/h3-5,8-9,12-14,17,21,28-29H,2,6-7,10-11,15-16H2,1H3