methyl (2S)-2-[[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[[(3S)-6-chlorochromane-3-carbonyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[[(3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(3S)-6-chloro-3,4-dihydro-2H-chromene-3-carbonyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(3S)-6-chlorochroman-3-carbonyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C14H16ClNO5 MolecularWeight: 313.73354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1CC2=C(C=CC(=C2)Cl)OC1

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)[C@H]1CC2=C(C=CC(=C2)Cl)OC1

InChI

InChI=1S/C14H16ClNO5/c1-20-14(19)11(6-17)16-13(18)9-4-8-5-10(15)2-3-12(8)21-7-9/h2-3,5,9,11,17H,4,6-7H2,1H3,(H,16,18)/t9-,11-/m0/s1