methyl 3-[(6-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoate

Systemtic Name: methyl 3-[(6-azanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoate Openeye Name: methyl 3-[(6-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoate CAS Name: 3-[(6-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(6-amino-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoate Traditional Name: 3-[(6-amino-3-keto-1,4-benzoxazin-4-yl)methyl]benzoic acid methyl ester Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)N

InChI

InChI=1S/C17H16N2O4/c1-22-17(21)12-4-2-3-11(7-12)9-19-14-8-13(18)5-6-15(14)23-10-16(19)20/h2-8H,9-10,18H2,1H3