tert-butyl (3E,5R)-3-(dimethylaminomethylidene)-2-oxidanylidene-5-[(4-phenylphenyl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3E,5R)-3-(dimethylaminomethylidene)-2-oxidanylidene-5-[(4-phenylphenyl)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3E,5R)-3-(dimethylaminomethylene)-2-oxo-5-[(4-phenylphenyl)methyl]pyrrolidine-1-carboxylate CAS Name: (3E,5R)-3-(dimethylaminomethylidene)-2-oxo-5-[(4-phenylphenyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3E,5R)-3-(dimethylaminomethylidene)-2-oxo-5-[(4-phenylphenyl)methyl]pyrrolidine-1-carboxylate Traditional Name: (3E,5R)-3-(dimethylaminomethylene)-2-keto-5-(4-phenylbenzyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC(=CN(C)C)C1=O)CC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](C/C(=C\N(C)C)/C1=O)CC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H30N2O3/c1-25(2,3)30-24(29)27-22(16-21(23(27)28)17-26(4)5)15-18-11-13-20(14-12-18)19-9-7-6-8-10-19/h6-14,17,22H,15-16H2,1-5H3/b21-17+/t22-/m1/s1