2-dimethylaminoethyl 1-[(2-azanylquinolin-4-yl)methyl]-6-fluoranyl-5-methyl-3-(2-oxidanylidene-1H-pyridin-3-yl)indole-2-carboxylate

Systemtic Name: 2-dimethylaminoethyl 1-[(2-azanylquinolin-4-yl)methyl]-6-fluoranyl-5-methyl-3-(2-oxidanylidene-1H-pyridin-3-yl)indole-2-carboxylate Openeye Name: 2-dimethylaminoethyl 1-[(2-amino-4-quinolyl)methyl]-6-fluoro-5-methyl-3-(2-oxo-1H-pyridin-3-yl)indole-2-carboxylate CAS Name: 1-[(2-amino-4-quinolinyl)methyl]-6-fluoro-5-methyl-3-(2-oxo-1H-pyridin-3-yl)-2-indolecarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 1-[(2-aminoquinolin-4-yl)methyl]-6-fluoro-5-methyl-3-(2-oxo-1H-pyridin-3-yl)indole-2-carboxylate Traditional Name: 1-[(2-amino-4-quinolyl)methyl]-6-fluoro-3-(2-keto-1H-pyridin-3-yl)-5-methyl-indole-2-carboxylic acid 2-dimethylaminoethyl ester Formula: C29H28FN5O3 MolecularWeight: 513.562723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N2CC3=CC(=NC4=CC=CC=C43)N)C(=O)OCCN(C)C)C5=CC=CNC5=O)F

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N2CC3=CC(=NC4=CC=CC=C43)N)C(=O)OCCN(C)C)C5=CC=CNC5=O)F

InChI

InChI=1S/C29H28FN5O3/c1-17-13-21-24(15-22(17)30)35(16-18-14-25(31)33-23-9-5-4-7-19(18)23)27(29(37)38-12-11-34(2)3)26(21)20-8-6-10-32-28(20)36/h4-10,13-15H,11-12,16H2,1-3H3,(H2,31,33)(H,32,36)