ethyl 3-cyano-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-oxidanylidene-quinolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-oxidanylidene-quinolizine-1-carboxylate Openeye Name: ethyl 3-cyano-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]-4-oxo-quinolizine-1-carboxylate CAS Name: 3-cyano-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-oxo-1-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-oxoquinolizine-1-carboxylate Traditional Name: 3-cyano-4-keto-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]quinolizine-1-carboxylic acid ethyl ester Formula: C20H18N6O5 MolecularWeight: 422.39412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1NCCNC3=NC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C(=O)C(=C1NCCNC3=NC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H18N6O5/c1-2-31-20(28)17-15-5-3-4-10-25(15)19(27)14(11-21)18(17)23-9-8-22-16-7-6-13(12-24-16)26(29)30/h3-7,10,12,23H,2,8-9H2,1H3,(H,22,24)