(phenylmethyl) N-[(2S)-1-oxidanylidene-1-[(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)amino]propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-1-[(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)amino]propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-methyl-2-oxo-2-[[2-(3-pyridyl)-2-pyrrolidin-1-yl-ethyl]amino]ethyl]carbamate CAS Name: N-[(2S)-1-oxo-1-[[2-(3-pyridinyl)-2-(1-pyrrolidinyl)ethyl]amino]propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-oxo-1-[(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)amino]propan-2-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-methyl-2-[[2-(3-pyridyl)-2-pyrrolidino-ethyl]amino]ethyl]carbamic acid benzyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(C1=CN=CC=C1)N2CCCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC(C1=CN=CC=C1)N2CCCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O3/c1-17(25-22(28)29-16-18-8-3-2-4-9-18)21(27)24-15-20(26-12-5-6-13-26)19-10-7-11-23-14-19/h2-4,7-11,14,17,20H,5-6,12-13,15-16H2,1H3,(H,24,27)(H,25,28)/t17-,20?/m0/s1