methyl (2S)-1-[1-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]phenoxy]cyclopentyl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[1-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]phenoxy]cyclopentyl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[1-[4-[2-(3,5-dimethylanilino)-2-oxo-ethyl]phenoxy]cyclopentanecarbonyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[[1-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]cyclopentyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[1-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]cyclopentanecarbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[1-[4-[2-(3,5-dimethylanilino)-2-keto-ethyl]phenoxy]cyclopentanecarbonyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C28H34N2O5 MolecularWeight: 478.57996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)OC3(CCCC3)C(=O)N4CCCC4C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)OC3(CCCC3)C(=O)N4CCC[C@H]4C(=O)OC)C

InChI

InChI=1S/C28H34N2O5/c1-19-15-20(2)17-22(16-19)29-25(31)18-21-8-10-23(11-9-21)35-28(12-4-5-13-28)27(33)30-14-6-7-24(30)26(32)34-3/h8-11,15-17,24H,4-7,12-14,18H2,1-3H3,(H,29,31)/t24-/m0/s1