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

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)methyl]-6,7,8-trimethoxy-quinazolin-4-amine Openeye Name: N-[(4-chloro-3-nitro-phenyl)methyl]-6,7,8-trimethoxy-quinazolin-4-amine CAS Name: N-[(4-chloro-3-nitrophenyl)methyl]-6,7,8-trimethoxy-4-quinazolinamine IUPAC Name: N-[(4-chloro-3-nitrophenyl)methyl]-6,7,8-trimethoxyquinazolin-4-amine Traditional Name: (4-chloro-3-nitro-benzyl)-(6,7,8-trimethoxyquinazolin-4-yl)amine Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN4O5/c1-26-14-7-11-15(17(28-3)16(14)27-2)21-9-22-18(11)20-8-10-4-5-12(19)13(6-10)23(24)25/h4-7,9H,8H2,1-3H3,(H,20,21,22)