tert-butyl N-[[4-[[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl-propanoyl-amino]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[[2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl-propanoyl-amino]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl-propanoyl-amino]phenyl]methyl]carbamate CAS Name: N-[[4-[[2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]methyl-(1-oxopropyl)amino]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[[2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl-propanoylamino]phenyl]methyl]carbamate Traditional Name: N-[4-[[2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl-propionyl-amino]benzyl]carbamic acid tert-butyl ester Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1CCN(C1=O)CCCC2=CC=CC=C2)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCC(=O)N(CC1CCN(C1=O)CCCC2=CC=CC=C2)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C29H39N3O4/c1-5-26(33)32(25-15-13-23(14-16-25)20-30-28(35)36-29(2,3)4)21-24-17-19-31(27(24)34)18-9-12-22-10-7-6-8-11-22/h6-8,10-11,13-16,24H,5,9,12,17-21H2,1-4H3,(H,30,35)