dimethyl-[2-[[3-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]phenyl]carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[3-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]phenyl]carbonylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[[3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]phenyl]-oxomethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoyl]amino]ethyl]azanium Traditional Name: 2-[[3-[(3-keto-7-methyl-1,4-benzoxazin-4-yl)methyl]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=CC(=C3)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=CC(=C3)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C21H25N3O3/c1-15-7-8-18-19(11-15)27-14-20(25)24(18)13-16-5-4-6-17(12-16)21(26)22-9-10-23(2)3/h4-8,11-12H,9-10,13-14H2,1-3H3,(H,22,26)/p+1