5-[(4-butylphenyl)carbonylamino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-butylphenyl)carbonylamino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-butylbenzoyl)amino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-butylphenyl)-oxomethyl]amino]-N-(3-ethoxypropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-butylbenzoyl)amino]-N-(3-ethoxypropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-butylbenzoyl)amino]-N-(3-ethoxypropyl)-2-pyrrolidino-benzamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCCOCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCCOCC

InChI

InChI=1S/C27H37N3O3/c1-3-5-9-21-10-12-22(13-11-21)26(31)29-23-14-15-25(30-17-6-7-18-30)24(20-23)27(32)28-16-8-19-33-4-2/h10-15,20H,3-9,16-19H2,1-2H3,(H,28,32)(H,29,31)