ethyl 4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]-6-nitro-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]-6-nitro-quinoline-3-carboxylate Openeye Name: ethyl 4-[[2-(dipropylamino)-2-oxo-ethyl]amino]-6-nitro-quinoline-3-carboxylate CAS Name: 4-[[2-(dipropylamino)-2-oxoethyl]amino]-6-nitro-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(dipropylamino)-2-oxoethyl]amino]-6-nitroquinoline-3-carboxylate Traditional Name: 4-[[2-(dipropylamino)-2-keto-ethyl]amino]-6-nitro-quinoline-3-carboxylic acid ethyl ester Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CNC1=C2C=C(C=CC2=NC=C1C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCC)C(=O)CNC1=C2C=C(C=CC2=NC=C1C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-4-9-23(10-5-2)18(25)13-22-19-15-11-14(24(27)28)7-8-17(15)21-12-16(19)20(26)29-6-3/h7-8,11-12H,4-6,9-10,13H2,1-3H3,(H,21,22)