6,7,8-trimethoxy-N-[(3-nitro-4-phenylmethoxy-phenyl)methyl]quinazolin-4-amine

Systemtic Name: 6,7,8-trimethoxy-N-[(3-nitro-4-phenylmethoxy-phenyl)methyl]quinazolin-4-amine Openeye Name: N-[(4-benzyloxy-3-nitro-phenyl)methyl]-6,7,8-trimethoxy-quinazolin-4-amine CAS Name: 6,7,8-trimethoxy-N-[(3-nitro-4-phenylmethoxyphenyl)methyl]-4-quinazolinamine IUPAC Name: 6,7,8-trimethoxy-N-[(3-nitro-4-phenylmethoxyphenyl)methyl]quinazolin-4-amine Traditional Name: (4-benzoxy-3-nitro-benzyl)-(6,7,8-trimethoxyquinazolin-4-yl)amine Formula: C25H24N4O6 MolecularWeight: 476.48126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C25H24N4O6/c1-32-21-12-18-22(24(34-3)23(21)33-2)27-15-28-25(18)26-13-17-9-10-20(19(11-17)29(30)31)35-14-16-7-5-4-6-8-16/h4-12,15H,13-14H2,1-3H3,(H,26,27,28)