ethyl 2-chloranyl-3-nitro-5-oxidanylidene-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylate

Systemtic Name: ethyl 2-chloranyl-3-nitro-5-oxidanylidene-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylate Openeye Name: ethyl 2-chloro-3-nitro-5-oxo-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylate CAS Name: 2-chloro-3-nitro-5-oxo-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-3-nitro-5-oxo-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylate Traditional Name: 2-chloro-5-keto-3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinoline-6-carboxylic acid ethyl ester Formula: C17H17ClN2O5 MolecularWeight: 364.78028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCCCN2C3=CC(=C(C=C3C1=O)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=C2CCCCCN2C3=CC(=C(C=C3C1=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H17ClN2O5/c1-2-25-17(22)15-12-6-4-3-5-7-19(12)13-9-11(18)14(20(23)24)8-10(13)16(15)21/h8-9H,2-7H2,1H3