(E)-3-[2-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-6-chloranyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-6-chloranyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-[(2-amino-2-oxo-ethyl)-methyl-amino]-6-chloro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-[(2-amino-2-oxoethyl)-methylamino]-6-chlorophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-[(2-amino-2-oxoethyl)-methylamino]-6-chlorophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[(2-amino-2-keto-ethyl)-methyl-amino]-6-chloro-phenyl]acrylic acid Formula: C12H13ClN2O3 MolecularWeight: 268.69622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N)C1=C(C(=CC=C1)Cl)C=CC(=O)O

Isomeric SMILES

CN(CC(=O)N)C1=C(C(=CC=C1)Cl)/C=C/C(=O)O

InChI

InChI=1S/C12H13ClN2O3/c1-15(7-11(14)16)10-4-2-3-9(13)8(10)5-6-12(17)18/h2-6H,7H2,1H3,(H2,14,16)(H,17,18)/b6-5+