2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]cyclopropane-1-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]cyclopropanecarboxylic acid CAS Name: 2-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-oxomethyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-methylcarbamoyl]cyclopropane-1-carboxylic acid Traditional Name: 2-[homoveratryl(methyl)carbamoyl]cyclopropanecarboxylic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC2C(=O)O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC2C(=O)O

InChI

InChI=1S/C16H21NO5/c1-17(15(18)11-9-12(11)16(19)20)7-6-10-4-5-13(21-2)14(8-10)22-3/h4-5,8,11-12H,6-7,9H2,1-3H3,(H,19,20)