methyl 2-[[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[[(E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[[(E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoyl]amino]-3-hydroxy-propanoate CAS Name: 2-[[(E)-3-(3-chloro-4-methylphenyl)-1-oxoprop-2-enyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(3-chloro-4-methylphenyl)prop-2-enoyl]amino]-3-hydroxypropanoate Traditional Name: 2-[[(E)-3-(3-chloro-4-methyl-phenyl)acryloyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C14H16ClNO4 MolecularWeight: 297.73414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)NC(CO)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)NC(CO)C(=O)OC)Cl

InChI

InChI=1S/C14H16ClNO4/c1-9-3-4-10(7-11(9)15)5-6-13(18)16-12(8-17)14(19)20-2/h3-7,12,17H,8H2,1-2H3,(H,16,18)/b6-5+