2-(2-azanylethylamino)-2-(3,4-dimethoxyphenyl)ethanoic acid

Systemtic Name: 2-(2-azanylethylamino)-2-(3,4-dimethoxyphenyl)ethanoic acid Openeye Name: 2-(2-aminoethylamino)-2-(3,4-dimethoxyphenyl)acetic acid CAS Name: 2-(2-aminoethylamino)-2-(3,4-dimethoxyphenyl)acetic acid IUPAC Name: 2-(2-aminoethylamino)-2-(3,4-dimethoxyphenyl)acetic acid Traditional Name: 2-(2-aminoethylamino)-2-(3,4-dimethoxyphenyl)acetic acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)O)NCCN)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)O)NCCN)OC

InChI

InChI=1S/C12H18N2O4/c1-17-9-4-3-8(7-10(9)18-2)11(12(15)16)14-6-5-13/h3-4,7,11,14H,5-6,13H2,1-2H3,(H,15,16)