ethyl 4-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxidanylidene-quinazolin-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxidanylidene-quinazolin-2-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxo-quinazolin-2-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxo-2-quinazolinyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxoquinazolin-2-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(2,4-dimethoxyphenyl)-4-keto-6-nitro-quinazolin-2-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H27N5O7 MolecularWeight: 497.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=C(C=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C24H27N5O7/c1-4-36-24(31)27-11-9-26(10-12-27)15-22-25-19-7-5-16(29(32)33)13-18(19)23(30)28(22)20-8-6-17(34-2)14-21(20)35-3/h5-8,13-14H,4,9-12,15H2,1-3H3