ethyl 1-butyl-4-nitro-7-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-butyl-4-nitro-7-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-butyl-4-nitro-7-oxo-quinoline-3-carboxylate CAS Name: 1-butyl-4-nitro-7-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-4-nitro-7-oxoquinoline-3-carboxylate Traditional Name: 1-butyl-7-keto-4-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=C2C1=CC(=O)C=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCCN1C=C(C(=C2C1=CC(=O)C=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C16H18N2O5/c1-3-5-8-17-10-13(16(20)23-4-2)15(18(21)22)12-7-6-11(19)9-14(12)17/h6-7,9-10H,3-5,8H2,1-2H3