2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylazanium

Systemtic Name: 2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylazanium Openeye Name: 2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylammonium CAS Name: 2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylammonium IUPAC Name: 2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylazanium Traditional Name: 3-keto-2-methyl-4H-1,4-benzoxazine-2-carboxylate; 1-phenylethylammonium Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH3+].CC1(C(=O)NC2=CC=CC=C2O1)C(=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)[NH3+].CC1(C(=O)NC2=CC=CC=C2O1)C(=O)[O-]

InChI

InChI=1S/C10H9NO4.C8H11N/c1-10(9(13)14)8(12)11-6-4-2-3-5-7(6)15-10;1-7(9)8-5-3-2-4-6-8/h2-5H,1H3,(H,11,12)(H,13,14);2-7H,9H2,1H3