ethyl 5-(2-methyl-3-pyridin-3-yl-indol-1-yl)pentanoate

Systemtic Name: ethyl 5-(2-methyl-3-pyridin-3-yl-indol-1-yl)pentanoate Openeye Name: ethyl 5-[2-methyl-3-(3-pyridyl)indol-1-yl]pentanoate CAS Name: 5-[2-methyl-3-(3-pyridinyl)-1-indolyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-(2-methyl-3-pyridin-3-ylindol-1-yl)pentanoate Traditional Name: 5-[2-methyl-3-(3-pyridyl)indol-1-yl]valeric acid ethyl ester Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C(=C(C2=CC=CC=C21)C3=CN=CC=C3)C

Isomeric SMILES

CCOC(=O)CCCCN1C(=C(C2=CC=CC=C21)C3=CN=CC=C3)C

InChI

InChI=1S/C21H24N2O2/c1-3-25-20(24)12-6-7-14-23-16(2)21(17-9-8-13-22-15-17)18-10-4-5-11-19(18)23/h4-5,8-11,13,15H,3,6-7,12,14H2,1-2H3