6,7-dimethoxy-4-[3-(4-nitrophenyl)piperazin-1-yl]quinazoline

Systemtic Name: 6,7-dimethoxy-4-[3-(4-nitrophenyl)piperazin-1-yl]quinazoline Openeye Name: 6,7-dimethoxy-4-[3-(4-nitrophenyl)piperazin-1-yl]quinazoline CAS Name: 6,7-dimethoxy-4-[3-(4-nitrophenyl)-1-piperazinyl]quinazoline IUPAC Name: 6,7-dimethoxy-4-[3-(4-nitrophenyl)piperazin-1-yl]quinazoline Traditional Name: 6,7-dimethoxy-4-[3-(4-nitrophenyl)piperazino]quinazoline Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCNC(C3)C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCNC(C3)C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N5O4/c1-28-18-9-15-16(10-19(18)29-2)22-12-23-20(15)24-8-7-21-17(11-24)13-3-5-14(6-4-13)25(26)27/h3-6,9-10,12,17,21H,7-8,11H2,1-2H3