2-[2-(3,4-dimethoxyphenyl)ethylamino]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]pyridine-3-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]pyridine-3-carboxylic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]pyridine-3-carboxylic acid Traditional Name: 2-(homoveratrylamino)nicotinic acid Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C=CC=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C=CC=N2)C(=O)O)OC

InChI

InChI=1S/C16H18N2O4/c1-21-13-6-5-11(10-14(13)22-2)7-9-18-15-12(16(19)20)4-3-8-17-15/h3-6,8,10H,7,9H2,1-2H3,(H,17,18)(H,19,20)