5-[(4-butylphenyl)carbonylamino]-N-(oxolan-2-ylmethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-butylphenyl)carbonylamino]-N-(oxolan-2-ylmethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-butylbenzoyl)amino]-2-pyrrolidin-1-yl-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 5-[[(4-butylphenyl)-oxomethyl]amino]-N-(2-oxolanylmethyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-butylbenzoyl)amino]-N-(oxolan-2-ylmethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-butylbenzoyl)amino]-2-pyrrolidino-N-(tetrahydrofurfuryl)benzamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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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)NCC4CCCO4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCC4CCCO4

InChI

InChI=1S/C27H35N3O3/c1-2-3-7-20-9-11-21(12-10-20)26(31)29-22-13-14-25(30-15-4-5-16-30)24(18-22)27(32)28-19-23-8-6-17-33-23/h9-14,18,23H,2-8,15-17,19H2,1H3,(H,28,32)(H,29,31)