7-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-quinazolin-4-amine

Systemtic Name: 7-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-quinazolin-4-amine Openeye Name: 7-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-quinazolin-4-amine CAS Name: 7-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-4-quinazolinamine IUPAC Name: 7-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitroquinazolin-4-amine Traditional Name: (7-chloro-6-nitro-quinazolin-4-yl)-homoveratryl-amine Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C18H17ClN4O4/c1-26-16-4-3-11(7-17(16)27-2)5-6-20-18-12-8-15(23(24)25)13(19)9-14(12)21-10-22-18/h3-4,7-10H,5-6H2,1-2H3,(H,20,21,22)