2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxidanylidene-6,8-dihydroquinoline-3-carboxylate

Systemtic Name: 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxidanylidene-6,8-dihydroquinoline-3-carboxylate Openeye Name: 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-6,8-dihydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-6,8-dihydroquinoline-3-carboxylate IUPAC Name: 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-6,8-dihydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(4-nitrophenyl)-6,8-dihydroquinoline-3-carboxylate Formula: C19H17N2O5- MolecularWeight: 353.34868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(=C2C(=N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H18N2O5/c1-10-15(18(23)24)16(11-4-6-12(7-5-11)21(25)26)17-13(20-10)8-19(2,3)9-14(17)22/h4-7H,8-9H2,1-3H3,(H,23,24)/p-1