methyl 5-[1-(3,4-dimethoxy-5-methoxycarbonyl-phenyl)-7-(methylamino)-7-oxidanylidene-hept-1-enyl]-2,3-dimethoxy-benzoate

Systemtic Name: methyl 5-[1-(3,4-dimethoxy-5-methoxycarbonyl-phenyl)-7-(methylamino)-7-oxidanylidene-hept-1-enyl]-2,3-dimethoxy-benzoate Openeye Name: methyl 5-[1-(3,4-dimethoxy-5-methoxycarbonyl-phenyl)-7-(methylamino)-7-oxo-hept-1-enyl]-2,3-dimethoxy-benzoate CAS Name: 5-[1-(3,4-dimethoxy-5-methoxycarbonylphenyl)-7-(methylamino)-7-oxohept-1-enyl]-2,3-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 5-[1-(3,4-dimethoxy-5-methoxycarbonylphenyl)-7-(methylamino)-7-oxohept-1-enyl]-2,3-dimethoxybenzoate Traditional Name: 5-[1-(3-carbomethoxy-4,5-dimethoxy-phenyl)-7-keto-7-(methylamino)hept-1-enyl]-2,3-dimethoxy-benzoic acid methyl ester Formula: C28H35NO9 MolecularWeight: 529.5788

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCCC=C(C1=CC(=C(C(=C1)OC)OC)C(=O)OC)C2=CC(=C(C(=C2)OC)OC)C(=O)OC

Isomeric SMILES

CNC(=O)CCCCC=C(C1=CC(=C(C(=C1)OC)OC)C(=O)OC)C2=CC(=C(C(=C2)OC)OC)C(=O)OC

InChI

InChI=1S/C28H35NO9/c1-29-24(30)12-10-8-9-11-19(17-13-20(27(31)37-6)25(35-4)22(15-17)33-2)18-14-21(28(32)38-7)26(36-5)23(16-18)34-3/h11,13-16H,8-10,12H2,1-7H3,(H,29,30)