2-[[4-(azepan-1-ylmethyl)phenyl]carbonylamino]-N-butyl-benzamide

Systemtic Name: 2-[[4-(azepan-1-ylmethyl)phenyl]carbonylamino]-N-butyl-benzamide Openeye Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-butyl-benzamide CAS Name: 2-[[[4-(1-azepanylmethyl)phenyl]-oxomethyl]amino]-N-butylbenzamide IUPAC Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-butylbenzamide Traditional Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-butyl-benzamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3CCCCCC3

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3CCCCCC3

InChI

InChI=1S/C25H33N3O2/c1-2-3-16-26-25(30)22-10-6-7-11-23(22)27-24(29)21-14-12-20(13-15-21)19-28-17-8-4-5-9-18-28/h6-7,10-15H,2-5,8-9,16-19H2,1H3,(H,26,30)(H,27,29)