2-[[(E)-3-(2-azanyl-4,5-dimethoxy-phenyl)-2-methyl-prop-2-enoyl]amino]pentanedioic acid

Systemtic Name: 2-[[(E)-3-(2-azanyl-4,5-dimethoxy-phenyl)-2-methyl-prop-2-enoyl]amino]pentanedioic acid Openeye Name: 2-[[(E)-3-(2-amino-4,5-dimethoxy-phenyl)-2-methyl-prop-2-enoyl]amino]pentanedioic acid CAS Name: 2-[[(E)-3-(2-amino-4,5-dimethoxyphenyl)-2-methyl-1-oxoprop-2-enyl]amino]pentanedioic acid IUPAC Name: 2-[[(E)-3-(2-amino-4,5-dimethoxyphenyl)-2-methylprop-2-enoyl]amino]pentanedioic acid Traditional Name: 2-[[(E)-3-(2-amino-4,5-dimethoxy-phenyl)-2-methyl-acryloyl]amino]glutaric acid Formula: C17H22N2O7 MolecularWeight: 366.36578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=C(C=C1N)OC)OC)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C/C(=C\C1=CC(=C(C=C1N)OC)OC)/C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C17H22N2O7/c1-9(16(22)19-12(17(23)24)4-5-15(20)21)6-10-7-13(25-2)14(26-3)8-11(10)18/h6-8,12H,4-5,18H2,1-3H3,(H,19,22)(H,20,21)(H,23,24)/b9-6+