N-(1-phenylethyl)-5-(3-phenylpropanoylamino)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(1-phenylethyl)-5-(3-phenylpropanoylamino)-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(1-phenylethyl)-5-(3-phenylpropanoylamino)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[(1-oxo-3-phenylpropyl)amino]-N-(1-phenylethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(1-phenylethyl)-5-(3-phenylpropanoylamino)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(hydrocinnamoylamino)-N-(1-phenylethyl)-2-pyrrolidino-benzamide Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)CCC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)CCC3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C28H31N3O2/c1-21(23-12-6-3-7-13-23)29-28(33)25-20-24(15-16-26(25)31-18-8-9-19-31)30-27(32)17-14-22-10-4-2-5-11-22/h2-7,10-13,15-16,20-21H,8-9,14,17-19H2,1H3,(H,29,33)(H,30,32)