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

Systemtic Name: 2-[(2R)-3-oxidanylidene-4-(3-phenylpropyl)-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-3-oxo-4-(3-phenylpropyl)-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-3-oxo-4-(3-phenylpropyl)-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-3-oxo-4-(3-phenylpropyl)-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-3-keto-4-(3-phenylpropyl)-1,4-benzoxazin-2-yl]acetic acid Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C3=CC=CC=C3OC(C2=O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C3=CC=CC=C3O[C@@H](C2=O)CC(=O)O

InChI

InChI=1S/C19H19NO4/c21-18(22)13-17-19(23)20(15-10-4-5-11-16(15)24-17)12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,17H,6,9,12-13H2,(H,21,22)/t17-/m1/s1