ethyl (2S)-2-[1-methyl-3-(6-methylpyridin-3-yl)carbonyl-indol-2-yl]propanoate

Systemtic Name: ethyl (2S)-2-[1-methyl-3-(6-methylpyridin-3-yl)carbonyl-indol-2-yl]propanoate Openeye Name: ethyl (2S)-2-[1-methyl-3-(6-methylpyridine-3-carbonyl)indol-2-yl]propanoate CAS Name: (2S)-2-[1-methyl-3-[(6-methyl-3-pyridinyl)-oxomethyl]-2-indolyl]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[1-methyl-3-(6-methylpyridine-3-carbonyl)indol-2-yl]propanoate Traditional Name: (2S)-2-[1-methyl-3-(6-methylnicotinoyl)indol-2-yl]propionic acid ethyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=C(C2=CC=CC=C2N1C)C(=O)C3=CN=C(C=C3)C

Isomeric SMILES

CCOC(=O)[C@@H](C)C1=C(C2=CC=CC=C2N1C)C(=O)C3=CN=C(C=C3)C

InChI

InChI=1S/C21H22N2O3/c1-5-26-21(25)14(3)19-18(16-8-6-7-9-17(16)23(19)4)20(24)15-11-10-13(2)22-12-15/h6-12,14H,5H2,1-4H3/t14-/m0/s1