N-[2-(1,3-benzodioxol-5-yl)ethyl]-7-chloranyl-6-nitro-quinazolin-4-amine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-7-chloranyl-6-nitro-quinazolin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-6-nitro-quinazolin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-6-nitro-4-quinazolinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-7-chloro-6-nitroquinazolin-4-amine Traditional Name: (7-chloro-6-nitro-quinazolin-4-yl)-homopiperonyl-amine Formula: C17H13ClN4O4 MolecularWeight: 372.76252

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC3=NC=NC4=CC(=C(C=C43)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC3=NC=NC4=CC(=C(C=C43)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13ClN4O4/c18-12-7-13-11(6-14(12)22(23)24)17(21-8-20-13)19-4-3-10-1-2-15-16(5-10)26-9-25-15/h1-2,5-8H,3-4,9H2,(H,19,20,21)