3-[3-azanyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-butyl-N-ethyl-propanamide

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-butyl-N-ethyl-propanamide Openeye Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-butyl-N-ethyl-propanamide CAS Name: 3-[3-amino-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-N-butyl-N-ethylpropanamide IUPAC Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-butyl-N-ethylpropanamide Traditional Name: 3-[3-amino-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-N-butyl-N-ethyl-propionamide Formula: C20H35N4O+ MolecularWeight: 347.5181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)CCC1=CC(=C(C=C1)N2CC[NH+](CC2)C)N

Isomeric SMILES

CCCCN(CC)C(=O)CCC1=CC(=C(C=C1)N2CC[NH+](CC2)C)N

InChI

InChI=1S/C20H34N4O/c1-4-6-11-23(5-2)20(25)10-8-17-7-9-19(18(21)16-17)24-14-12-22(3)13-15-24/h7,9,16H,4-6,8,10-15,21H2,1-3H3/p+1