N-[2-[2-(4-bromophenyl)ethylamino]-1,1,5-trimethyl-4-oxidanylidene-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethyl-carbamate

Systemtic Name: N-[2-[2-(4-bromophenyl)ethylamino]-1,1,5-trimethyl-4-oxidanylidene-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethyl-carbamate Openeye Name: N-[2-[2-(4-bromophenyl)ethylamino]-1,1,5-trimethyl-4-oxo-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethyl-carbamate CAS Name: N-[2-[2-(4-bromophenyl)ethylamino]-1,1,5-trimethyl-4-oxo-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethylcarbamate IUPAC Name: N-[2-[2-(4-bromophenyl)ethylamino]-1,1,5-trimethyl-4-oxo-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethylcarbamate Traditional Name: N-[2-[2-(4-bromophenyl)ethylamino]-4-keto-1,1,5-trimethyl-2H-3,1-benzoxazin-1-ium-6-yl]-N-ethyl-carbamate Formula: C22H26BrN3O4 MolecularWeight: 476.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C2=C(C=C1)[N+](C(OC2=O)NCCC3=CC=C(C=C3)Br)(C)C)C)C(=O)[O-]

Isomeric SMILES

CCN(C1=C(C2=C(C=C1)[N+](C(OC2=O)NCCC3=CC=C(C=C3)Br)(C)C)C)C(=O)[O-]

InChI

InChI=1S/C22H26BrN3O4/c1-5-25(22(28)29)17-10-11-18-19(14(17)2)20(27)30-21(26(18,3)4)24-13-12-15-6-8-16(23)9-7-15/h6-11,21,24H,5,12-13H2,1-4H3