[(3R)-4,4-dimethyl-1-(2-pyridin-3-ylethanoyl)pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate

Systemtic Name: [(3R)-4,4-dimethyl-1-(2-pyridin-3-ylethanoyl)pyrrolidin-3-yl] N-[(3S)-1,2-bis(oxidanylidene)-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Openeye Name: [(3R)-4,4-dimethyl-1-[2-(3-pyridyl)acetyl]pyrrolidin-3-yl] N-[(1S)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamate CAS Name: N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamic acid [(3R)-4,4-dimethyl-1-[1-oxo-2-(3-pyridinyl)ethyl]-3-pyrrolidinyl] ester IUPAC Name: [(3R)-4,4-dimethyl-1-(2-pyridin-3-ylacetyl)pyrrolidin-3-yl] N-[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamate Traditional Name: N-[(1S)-1-[2-keto-2-[[(1R)-1-phenylethyl]amino]acetyl]pentyl]carbamic acid [(3R)-4,4-dimethyl-1-[2-(3-pyridyl)acetyl]pyrrolidin-3-yl] ester Formula: C29H38N4O5 MolecularWeight: 522.63582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=O)NC(C)C1=CC=CC=C1)NC(=O)OC2CN(CC2(C)C)C(=O)CC3=CN=CC=C3

Isomeric SMILES

CCCC[C@@H](C(=O)C(=O)N[C@H](C)C1=CC=CC=C1)NC(=O)O[C@H]2CN(CC2(C)C)C(=O)CC3=CN=CC=C3

InChI

InChI=1S/C29H38N4O5/c1-5-6-14-23(26(35)27(36)31-20(2)22-12-8-7-9-13-22)32-28(37)38-24-18-33(19-29(24,3)4)25(34)16-21-11-10-15-30-17-21/h7-13,15,17,20,23-24H,5-6,14,16,18-19H2,1-4H3,(H,31,36)(H,32,37)/t20-,23+,24+/m1/s1