5-(dodecanoylamino)-N-phenethyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-(dodecanoylamino)-N-phenethyl-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-(dodecanoylamino)-N-phenethyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-(1-oxododecylamino)-N-phenethyl-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-(dodecanoylamino)-N-phenethyl-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(lauroylamino)-N-phenethyl-2-pyrrolidino-benzamide Formula: C31H45N3O2 MolecularWeight: 491.7079

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C31H45N3O2/c1-2-3-4-5-6-7-8-9-13-18-30(35)33-27-19-20-29(34-23-14-15-24-34)28(25-27)31(36)32-22-21-26-16-11-10-12-17-26/h10-12,16-17,19-20,25H,2-9,13-15,18,21-24H2,1H3,(H,32,36)(H,33,35)