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

Systemtic Name: [3-[(2S)-4-oxidanylidene-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] butanoate Openeye Name: [3-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] butanoate CAS Name: butanoic acid [3-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] ester IUPAC Name: [3-[(2S)-4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] butanoate Traditional Name: butyric acid [3-[(2S)-4-keto-2,3-dihydro-1,3-benzoxazin-2-yl]phenyl] ester Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=CC(=C1)C2NC(=O)C3=CC=CC=C3O2

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO4/c1-2-6-16(20)22-13-8-5-7-12(11-13)18-19-17(21)14-9-3-4-10-15(14)23-18/h3-5,7-11,18H,2,6H2,1H3,(H,19,21)/t18-/m0/s1