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

Systemtic Name: 3-(4-methoxyphenyl)-2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]propanoic acid Openeye Name: 3-(4-methoxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid CAS Name: 3-(4-methoxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid IUPAC Name: 3-(4-methoxyphenyl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid Traditional Name: 2-[(4-keto-5-methyl-3,1-benzoxazin-2-yl)amino]-3-(4-methoxyphenyl)propionic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O5/c1-11-4-3-5-14-16(11)18(24)26-19(20-14)21-15(17(22)23)10-12-6-8-13(25-2)9-7-12/h3-9,15H,10H2,1-2H3,(H,20,21)(H,22,23)