2-(3,4-dimethoxyphenyl)ethyl-[(3R)-1-[4-[(3R)-3-[2-(3,4-dimethoxyphenyl)ethylazaniumyl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3R)-1-[4-[(3R)-3-[2-(3,4-dimethoxyphenyl)ethylazaniumyl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]-2,5-bis(oxidanylidene)pyrrolidin-3-yl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3R)-1-[4-[(3R)-3-[2-(3,4-dimethoxyphenyl)ethylammonio]-2,5-dioxo-pyrrolidin-1-yl]phenyl]-2,5-dioxo-pyrrolidin-3-yl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3R)-1-[4-[(3R)-3-[2-(3,4-dimethoxyphenyl)ethylammonio]-2,5-dioxo-1-pyrrolidinyl]phenyl]-2,5-dioxo-3-pyrrolidinyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3R)-1-[4-[(3R)-3-[2-(3,4-dimethoxyphenyl)ethylazaniumyl]-2,5-dioxopyrrolidin-1-yl]phenyl]-2,5-dioxopyrrolidin-3-yl]azanium Traditional Name: homoveratryl-[(3R)-1-[4-[(3R)-3-(homoveratrylammonio)-2,5-diketo-pyrrolidino]phenyl]-2,5-diketo-pyrrolidin-3-yl]ammonium Formula: C34H40N4O8+2 MolecularWeight: 632.7034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]C2CC(=O)N(C2=O)C3=CC=C(C=C3)N4C(=O)CC(C4=O)[NH2+]CCC5=CC(=C(C=C5)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+][C@@H]2CC(=O)N(C2=O)C3=CC=C(C=C3)N4C(=O)C[C@H](C4=O)[NH2+]CCC5=CC(=C(C=C5)OC)OC)OC

InChI

InChI=1S/C34H38N4O8/c1-43-27-11-5-21(17-29(27)45-3)13-15-35-25-19-31(39)37(33(25)41)23-7-9-24(10-8-23)38-32(40)20-26(34(38)42)36-16-14-22-6-12-28(44-2)30(18-22)46-4/h5-12,17-18,25-26,35-36H,13-16,19-20H2,1-4H3/p+2/t25-,26-/m1/s1