4-(6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(6-nitro-4-quinazolinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C25H22N6O4 MolecularWeight: 470.47998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H22N6O4/c32-25(28-18-6-9-21(10-7-18)35-20-4-2-1-3-5-20)30-14-12-29(13-15-30)24-22-16-19(31(33)34)8-11-23(22)26-17-27-24/h1-11,16-17H,12-15H2,(H,28,32)