(2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-[2-(4-bromophenyl)ethyl]-N-tert-butyl-carbamate

Systemtic Name: (2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-[2-(4-bromophenyl)ethyl]-N-tert-butyl-carbamate Openeye Name: (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) N-[2-(4-bromophenyl)ethyl]-N-tert-butyl-carbamate CAS Name: N-[2-(4-bromophenyl)ethyl]-N-tert-butylcarbamic acid (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) ester IUPAC Name: (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) N-[2-(4-bromophenyl)ethyl]-N-tert-butylcarbamate Traditional Name: N-[2-(4-bromophenyl)ethyl]-N-tert-butyl-carbamic acid (2-amino-4-keto-5-methyl-3,1-benzoxazin-6-yl) ester Formula: C22H24BrN3O4 MolecularWeight: 474.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N)OC(=O)N(CCC3=CC=C(C=C3)Br)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N)OC(=O)N(CCC3=CC=C(C=C3)Br)C(C)(C)C

InChI

InChI=1S/C22H24BrN3O4/c1-13-17(10-9-16-18(13)19(27)30-20(24)25-16)29-21(28)26(22(2,3)4)12-11-14-5-7-15(23)8-6-14/h5-10H,11-12H2,1-4H3,(H2,24,25)