methyl (2S)-2-[[4-[(4-chloranylphenoxy)methyl]phenyl]carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[4-[(4-chloranylphenoxy)methyl]phenyl]carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[[4-[(4-chlorophenoxy)methyl]benzoyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[[4-[(4-chlorophenoxy)methyl]phenyl]-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-[(4-chlorophenoxy)methyl]benzoyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[4-[(4-chlorophenoxy)methyl]benzoyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO5/c1-24-18(23)16(10-21)20-17(22)13-4-2-12(3-5-13)11-25-15-8-6-14(19)7-9-15/h2-9,16,21H,10-11H2,1H3,(H,20,22)/t16-/m0/s1