tert-butyl N-(3-bromophenyl)-N-(6-nitroquinazolin-4-yl)carbamate

Systemtic Name: tert-butyl N-(3-bromophenyl)-N-(6-nitroquinazolin-4-yl)carbamate Openeye Name: tert-butyl N-(3-bromophenyl)-N-(6-nitroquinazolin-4-yl)carbamate CAS Name: N-(3-bromophenyl)-N-(6-nitro-4-quinazolinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-bromophenyl)-N-(6-nitroquinazolin-4-yl)carbamate Traditional Name: N-(3-bromophenyl)-N-(6-nitroquinazolin-4-yl)carbamic acid tert-butyl ester Formula: C19H17BrN4O4 MolecularWeight: 445.26668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC(=CC=C1)Br)C2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC(=CC=C1)Br)C2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17BrN4O4/c1-19(2,3)28-18(25)23(13-6-4-5-12(20)9-13)17-15-10-14(24(26)27)7-8-16(15)21-11-22-17/h4-11H,1-3H3