(phenylmethyl) (2S)-2-[(3-chloranyl-4-methoxy-phenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[(3-chloranyl-4-methoxy-phenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: benzyl (2S)-2-[(3-chloro-4-methoxy-benzoyl)amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[(3-chloro-4-methoxyphenyl)-oxomethyl]amino]-3-hydroxypropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(3-chloro-4-methoxybenzoyl)amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[(3-chloro-4-methoxy-benzoyl)amino]-3-hydroxy-propionic acid benzyl ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(CO)C(=O)OCC2=CC=CC=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N[C@@H](CO)C(=O)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C18H18ClNO5/c1-24-16-8-7-13(9-14(16)19)17(22)20-15(10-21)18(23)25-11-12-5-3-2-4-6-12/h2-9,15,21H,10-11H2,1H3,(H,20,22)/t15-/m0/s1