2-[(2R)-4-[(3-chlorophenyl)methyl]-6-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2R)-4-[(3-chlorophenyl)methyl]-6-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-4-[(3-chlorophenyl)methyl]-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-4-[(3-chlorophenyl)methyl]-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-4-[(3-chlorophenyl)methyl]-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-4-(3-chlorobenzyl)-3-keto-6-methyl-1,4-benzoxazin-2-yl]acetic acid Formula: C18H16ClNO4 MolecularWeight: 345.77694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(C(=O)N2CC3=CC(=CC=C3)Cl)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@@H](C(=O)N2CC3=CC(=CC=C3)Cl)CC(=O)O

InChI

InChI=1S/C18H16ClNO4/c1-11-5-6-15-14(7-11)20(10-12-3-2-4-13(19)8-12)18(23)16(24-15)9-17(21)22/h2-8,16H,9-10H2,1H3,(H,21,22)/t16-/m1/s1