methyl 2-[(4-cyanophenyl)carbamoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-cyanophenyl)carbamoylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[(4-cyanophenyl)carbamoylamino]-3-hydroxy-propanoate CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(4-cyanophenyl)carbamoylamino]-3-hydroxypropanoate Traditional Name: 2-[(4-cyanophenyl)carbamoylamino]-3-hydroxy-propionic acid methyl ester Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

COC(=O)C(CO)NC(=O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H13N3O4/c1-19-11(17)10(7-16)15-12(18)14-9-4-2-8(6-13)3-5-9/h2-5,10,16H,7H2,1H3,(H2,14,15,18)