3-[2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]-2-oxidanylidene-ethyl]-4-methylidene-hex-5-enoic acid

Systemtic Name: 3-[2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]-2-oxidanylidene-ethyl]-4-methylidene-hex-5-enoic acid Openeye Name: 3-[2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]-2-oxo-ethyl]-4-methylene-hex-5-enoic acid CAS Name: 3-[2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]-2-oxoethyl]-4-methylene-5-hexenoic acid IUPAC Name: 3-[2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]-2-oxoethyl]-4-methylidenehex-5-enoic acid Traditional Name: 3-[2-keto-2-[2-[3-methoxy-4-(2-methoxyethoxymethoxy)phenyl]ethylamino]ethyl]-4-methylene-hex-5-enoic acid Formula: C22H31NO7 MolecularWeight: 421.48404

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC1=C(C=C(C=C1)CCNC(=O)CC(CC(=O)O)C(=C)C=C)OC

Isomeric SMILES

COCCOCOC1=C(C=C(C=C1)CCNC(=O)CC(CC(=O)O)C(=C)C=C)OC

InChI

InChI=1S/C22H31NO7/c1-5-16(2)18(14-22(25)26)13-21(24)23-9-8-17-6-7-19(20(12-17)28-4)30-15-29-11-10-27-3/h5-7,12,18H,1-2,8-11,13-15H2,3-4H3,(H,23,24)(H,25,26)