4-[(aminocarbonylamino)methyl]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide

Systemtic Name: 4-[(aminocarbonylamino)methyl]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(ureidomethyl)benzamide CAS Name: 4-[(carbamoylamino)methyl]-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzamide IUPAC Name: 4-[(carbamoylamino)methyl]-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(ureidomethyl)benzamide Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)CNC(=O)N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)CNC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H27N5O2/c22-21(28)24-16-17-6-8-18(9-7-17)20(27)23-10-11-25-12-14-26(15-13-25)19-4-2-1-3-5-19/h1-9H,10-16H2,(H,23,27)(H3,22,24,28)/p+1