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

Systemtic Name: cyclohexyl-methyl-[[2-[(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)carbonylamino]phenyl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[2-[(3-oxo-4H-1,4-benzoxazine-7-carbonyl)amino]phenyl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[2-[[oxo-(3-oxo-4H-1,4-benzoxazin-7-yl)methyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[(3-oxo-4H-1,4-benzoxazine-7-carbonyl)amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-[2-[(3-keto-4H-1,4-benzoxazine-7-carbonyl)amino]benzyl]-methyl-ammonium Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)NC(=O)CO3)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)NC(=O)CO3)C4CCCCC4

InChI

InChI=1S/C23H27N3O3/c1-26(18-8-3-2-4-9-18)14-17-7-5-6-10-19(17)25-23(28)16-11-12-20-21(13-16)29-15-22(27)24-20/h5-7,10-13,18H,2-4,8-9,14-15H2,1H3,(H,24,27)(H,25,28)/p+1