2-azanyl-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-dione

Systemtic Name: 2-azanyl-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-dione Openeye Name: 2-amino-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-dione CAS Name: 2-amino-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-dione IUPAC Name: 2-amino-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-dione Traditional Name: 2-amino-5-(4-nitrophenyl)-1,7,8,9-tetrahydropyrimido[4,5-b]quinoline-4,6-quinone Formula: C17H13N5O4 MolecularWeight: 351.31622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=C3C(=N2)NC(=NC3=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=C3C(=N2)NC(=NC3=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O4/c18-17-20-15-14(16(24)21-17)12(8-4-6-9(7-5-8)22(25)26)13-10(19-15)2-1-3-11(13)23/h4-7H,1-3H2,(H3,18,19,20,21,24)