2-[(2S)-4-[2-(4-methylphenoxy)ethyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-4-[2-(4-methylphenoxy)ethyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2S)-4-[2-(4-methylphenoxy)ethyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2S)-4-[2-(4-methylphenoxy)ethyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2S)-4-[2-(4-methylphenoxy)ethyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2S)-3-keto-4-[2-(4-methylphenoxy)ethyl]-1,4-benzoxazin-2-yl]acetic acid Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3OC(C2=O)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OCCN2C3=CC=CC=C3O[C@H](C2=O)CC(=O)O

InChI

InChI=1S/C19H19NO5/c1-13-6-8-14(9-7-13)24-11-10-20-15-4-2-3-5-16(15)25-17(19(20)23)12-18(21)22/h2-9,17H,10-12H2,1H3,(H,21,22)/t17-/m0/s1