2-(2-chlorophenyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]quinazolin-4-amine

Systemtic Name: 2-(2-chlorophenyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]quinazolin-4-amine Openeye Name: 2-(2-chlorophenyl)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]quinazolin-4-amine CAS Name: 2-(2-chlorophenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-4-quinazolinamine IUPAC Name: 2-(2-chlorophenyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]quinazolin-4-amine Traditional Name: [2-(2-chlorophenyl)quinazolin-4-yl]-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]amine Formula: C28H21ClN4O4 MolecularWeight: 512.94374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C28H21ClN4O4/c1-2-36-20-11-13-21(14-12-20)37-22-16-18(15-19(17-22)33(34)35)30-28-24-8-4-6-10-26(24)31-27(32-28)23-7-3-5-9-25(23)29/h3-17H,2H2,1H3,(H,30,31,32)