3-(4-hydroxyphenyl)-2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[(4-keto-5-methyl-3,1-benzoxazin-2-yl)amino]propionic acid Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CC3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CC3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C18H16N2O5/c1-10-3-2-4-13-15(10)17(24)25-18(19-13)20-14(16(22)23)9-11-5-7-12(21)8-6-11/h2-8,14,21H,9H2,1H3,(H,19,20)(H,22,23)