4-[(aminocarbonylamino)methyl]-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 4-[(aminocarbonylamino)methyl]-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-(ureidomethyl)benzamide CAS Name: 4-[(carbamoylamino)methyl]-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 4-[(carbamoylamino)methyl]-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-4-(ureidomethyl)benzamide Formula: C21H26ClN4O2+ MolecularWeight: 401.90974

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)CNC(=O)N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)CNC(=O)N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN4O2/c22-18-7-3-16(4-8-18)14-26-11-9-19(10-12-26)25-20(27)17-5-1-15(2-6-17)13-24-21(23)28/h1-8,19H,9-14H2,(H,25,27)(H3,23,24,28)/p+1