ethyl 3-[(6-chloranylpyridin-3-yl)methyl-methyl-amino]-2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[(6-chloranylpyridin-3-yl)methyl-methyl-amino]-2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[(6-chloro-3-pyridyl)methyl-methyl-amino]-2-(1-methyl-3-nitro-2-oxo-4-quinolyl)-3-oxo-propanoate CAS Name: 3-[(6-chloro-3-pyridinyl)methyl-methylamino]-2-(1-methyl-3-nitro-2-oxo-4-quinolinyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[(6-chloropyridin-3-yl)methyl-methylamino]-2-(1-methyl-3-nitro-2-oxoquinolin-4-yl)-3-oxopropanoate Traditional Name: 3-[(6-chloro-3-pyridyl)methyl-methyl-amino]-3-keto-2-(2-keto-1-methyl-3-nitro-4-quinolyl)propionic acid ethyl ester Formula: C22H21ClN4O6 MolecularWeight: 472.87834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C)[N+](=O)[O-])C(=O)N(C)CC3=CN=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C)[N+](=O)[O-])C(=O)N(C)CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H21ClN4O6/c1-4-33-22(30)18(20(28)25(2)12-13-9-10-16(23)24-11-13)17-14-7-5-6-8-15(14)26(3)21(29)19(17)27(31)32/h5-11,18H,4,12H2,1-3H3