2-[4-[[(3S)-1-oxidanylidene-3,4-dihydroisochromen-3-yl]carbonylamino]phenyl]ethanoate

Systemtic Name: 2-[4-[[(3S)-1-oxidanylidene-3,4-dihydroisochromen-3-yl]carbonylamino]phenyl]ethanoate Openeye Name: 2-[4-[[(3S)-1-oxoisochromane-3-carbonyl]amino]phenyl]acetate CAS Name: 2-[4-[[oxo-[(3S)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl]methyl]amino]phenyl]acetate IUPAC Name: 2-[4-[[(3S)-1-oxo-3,4-dihydroisochromene-3-carbonyl]amino]phenyl]acetate Traditional Name: 2-[4-[[(3S)-1-ketoisochroman-3-carbonyl]amino]phenyl]acetate Formula: C18H14NO5- MolecularWeight: 324.30746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)CC(=O)[O-]

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C18H15NO5/c20-16(21)9-11-5-7-13(8-6-11)19-17(22)15-10-12-3-1-2-4-14(12)18(23)24-15/h1-8,15H,9-10H2,(H,19,22)(H,20,21)/p-1/t15-/m0/s1