5-[(4-hexylphenyl)carbonylamino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-hexylphenyl)carbonylamino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-hexylbenzoyl)amino]-N-phenethyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-hexylphenyl)-oxomethyl]amino]-N-phenethyl-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-hexylbenzoyl)amino]-N-phenethyl-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-hexylbenzoyl)amino]-N-phenethyl-2-pyrrolidino-benzamide Formula: C32H39N3O2 MolecularWeight: 497.67096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C32H39N3O2/c1-2-3-4-6-13-26-14-16-27(17-15-26)31(36)34-28-18-19-30(35-22-9-10-23-35)29(24-28)32(37)33-21-20-25-11-7-5-8-12-25/h5,7-8,11-12,14-19,24H,2-4,6,9-10,13,20-23H2,1H3,(H,33,37)(H,34,36)