ethyl 4-[[1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-3,5-diphenyl-pyrrolidin-2-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-3,5-diphenyl-pyrrolidin-2-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-3,5-diphenyl-pyrrolidine-2-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(3,3-dimethyl-1-oxobutyl)-4-methoxycarbonyl-3,5-diphenyl-2-pyrrolidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(3,3-dimethylbutanoyl)-4-methoxycarbonyl-3,5-diphenylpyrrolidine-2-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-carbomethoxy-1-(3,3-dimethylbutanoyl)-3,5-diphenyl-prolyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C33H43N3O6 MolecularWeight: 577.71102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2C(C(C(N2C(=O)CC(C)(C)C)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2C(C(C(N2C(=O)CC(C)(C)C)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C33H43N3O6/c1-6-42-32(40)35-19-17-24(18-20-35)34-30(38)29-26(22-13-9-7-10-14-22)27(31(39)41-5)28(23-15-11-8-12-16-23)36(29)25(37)21-33(2,3)4/h7-16,24,26-29H,6,17-21H2,1-5H3,(H,34,38)