2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]benzamide CAS Name: 2-[[oxo-[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]benzamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C23H27N3O2/c1-2-14-24-23(28)20-8-4-5-9-21(20)25-22(27)19-12-10-18(11-13-19)17-26-15-6-3-7-16-26/h2,4-5,8-13H,1,3,6-7,14-17H2,(H,24,28)(H,25,27)/p+1