7-[dodecyl-[3-methyl-5-nitro-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]amino]-3-methyl-1H-quinazoline-2,4-dione

Systemtic Name: 7-[dodecyl-[3-methyl-5-nitro-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]amino]-3-methyl-1H-quinazoline-2,4-dione Openeye Name: 7-[dodecyl-(3-methyl-5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)amino]-3-methyl-1H-quinazoline-2,4-dione CAS Name: 7-[dodecyl-(3-methyl-5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)amino]-3-methyl-1H-quinazoline-2,4-dione IUPAC Name: 7-[dodecyl-(3-methyl-5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)amino]-3-methyl-1H-quinazoline-2,4-dione Traditional Name: 7-[(2,4-diketo-3-methyl-5-nitro-1H-pyrimidin-6-yl)-lauryl-amino]-3-methyl-1H-quinazoline-2,4-quinone Formula: C26H36N6O6 MolecularWeight: 528.60064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C1=CC2=C(C=C1)C(=O)N(C(=O)N2)C)C3=C(C(=O)N(C(=O)N3)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCN(C1=CC2=C(C=C1)C(=O)N(C(=O)N2)C)C3=C(C(=O)N(C(=O)N3)C)[N+](=O)[O-]

InChI

InChI=1S/C26H36N6O6/c1-4-5-6-7-8-9-10-11-12-13-16-31(22-21(32(37)38)24(34)30(3)26(36)28-22)18-14-15-19-20(17-18)27-25(35)29(2)23(19)33/h14-15,17H,4-13,16H2,1-3H3,(H,27,35)(H,28,36)