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

Systemtic Name: phenyl 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate Openeye Name: 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 phenyl ester IUPAC Name: phenyl 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 phenyl ester Formula: C27H21ClN2O2 MolecularWeight: 440.92084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21ClN2O2/c28-19-14-16-24-22(17-19)21(10-6-12-26(31)32-20-8-2-1-3-9-20)27(30-24)25-15-13-18-7-4-5-11-23(18)29-25/h1-5,7-9,11,13-17,30H,6,10,12H2