5-[(2-chloranyl-2-phenyl-ethanoyl)amino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(2-chloranyl-2-phenyl-ethanoyl)amino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(2-chloro-2-phenyl-acetyl)amino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[(2-chloro-1-oxo-2-phenylethyl)amino]-N-phenethyl-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(2-chloro-2-phenylacetyl)amino]-N-phenethyl-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(2-chloro-2-phenyl-acetyl)amino]-N-phenethyl-2-pyrrolidino-benzamide Formula: C27H28ClN3O2 MolecularWeight: 461.98312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)Cl)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)Cl)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H28ClN3O2/c28-25(21-11-5-2-6-12-21)27(33)30-22-13-14-24(31-17-7-8-18-31)23(19-22)26(32)29-16-15-20-9-3-1-4-10-20/h1-6,9-14,19,25H,7-8,15-18H2,(H,29,32)(H,30,33)