naphthalen-1-yl 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate

Systemtic Name: naphthalen-1-yl 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Openeye Name: 1-naphthyl 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]butanoic acid 1-naphthalenyl ester IUPAC Name: naphthalen-1-yl 4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butyric acid 1-naphthyl ester Formula: C27H21ClN2O2 MolecularWeight: 440.92084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

InChI

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