2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxidanylidene-4-(pyridin-3-ylamino)butanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxidanylidene-4-(pyridin-3-ylamino)butanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxo-4-(3-pyridylamino)butanoic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxo-4-(3-pyridinylamino)butanoic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-oxo-4-(pyridin-3-ylamino)butanoic acid Traditional Name: 2-(homoveratrylamino)-4-keto-4-(3-pyridylamino)butyric acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(CC(=O)NC2=CN=CC=C2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(CC(=O)NC2=CN=CC=C2)C(=O)O)OC

InChI

InChI=1S/C19H23N3O5/c1-26-16-6-5-13(10-17(16)27-2)7-9-21-15(19(24)25)11-18(23)22-14-4-3-8-20-12-14/h3-6,8,10,12,15,21H,7,9,11H2,1-2H3,(H,22,23)(H,24,25)