(5-methyl-2-propan-2-yl-phenyl) 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate Openeye Name: (2-isopropyl-5-methyl-phenyl) 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]butanoic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butyric acid (2-isopropyl-5-methyl-phenyl) ester Formula: C31H29ClN2O2 MolecularWeight: 497.02716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H29ClN2O2/c1-19(2)23-14-11-20(3)17-29(23)36-30(35)10-6-8-24-25-18-22(32)13-16-27(25)34-31(24)28-15-12-21-7-4-5-9-26(21)33-28/h4-5,7,9,11-19,34H,6,8,10H2,1-3H3