[2-methoxy-4-[(2S)-4-oxidanylidene-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] propanoate

Systemtic Name: [2-methoxy-4-[(2S)-4-oxidanylidene-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] propanoate Openeye Name: [2-methoxy-4-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] propanoate CAS Name: propanoic acid [2-methoxy-4-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] ester IUPAC Name: [2-methoxy-4-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] propanoate Traditional Name: propionic acid [4-[(2S)-4-keto-2,3-dihydro-1,3-benzoxazin-2-yl]-2-methoxy-phenyl] ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)C2NC(=O)C3=CC=CC=C3O2)OC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)[C@H]2NC(=O)C3=CC=CC=C3O2)OC

InChI

InChI=1S/C18H17NO5/c1-3-16(20)23-14-9-8-11(10-15(14)22-2)18-19-17(21)12-6-4-5-7-13(12)24-18/h4-10,18H,3H2,1-2H3,(H,19,21)/t18-/m0/s1