tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]carbamoyl]-6-phenyl-hexanoate

Systemtic Name: tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]carbamoyl]-6-phenyl-hexanoate Openeye Name: tert-butyl (3R)-3-[[(1S)-2,2-dimethyl-1-(pyrrolidine-1-carbonyl)propyl]carbamoyl]-6-phenyl-hexanoate CAS Name: (3R)-3-[[[(2S)-3,3-dimethyl-1-oxo-1-(1-pyrrolidinyl)butan-2-yl]amino]-oxomethyl]-6-phenylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(2S)-3,3-dimethyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]carbamoyl]-6-phenylhexanoate Traditional Name: (3R)-3-[[(1S)-2,2-dimethyl-1-(pyrrolidine-1-carbonyl)propyl]carbamoyl]-6-phenyl-hexanoic acid tert-butyl ester Formula: C27H42N2O4 MolecularWeight: 458.63338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCCC1)NC(=O)C(CCCC2=CC=CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N1CCCC1)NC(=O)[C@H](CCCC2=CC=CC=C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C27H42N2O4/c1-26(2,3)23(25(32)29-17-10-11-18-29)28-24(31)21(19-22(30)33-27(4,5)6)16-12-15-20-13-8-7-9-14-20/h7-9,13-14,21,23H,10-12,15-19H2,1-6H3,(H,28,31)/t21-,23-/m1/s1