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

Systemtic Name: 5-[(4-hexylphenyl)carbonylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-hexylbenzoyl)amino]-N-isobutyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-hexylphenyl)-oxomethyl]amino]-N-(2-methylpropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-hexylbenzoyl)amino]-N-(2-methylpropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-hexylbenzoyl)amino]-N-isobutyl-2-pyrrolidino-benzamide Formula: C28H39N3O2 MolecularWeight: 449.62816

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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)NCC(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC(C)C

InChI

InChI=1S/C28H39N3O2/c1-4-5-6-7-10-22-11-13-23(14-12-22)27(32)30-24-15-16-26(31-17-8-9-18-31)25(19-24)28(33)29-20-21(2)3/h11-16,19,21H,4-10,17-18,20H2,1-3H3,(H,29,33)(H,30,32)