(5-azanyl-2-chloranyl-phenyl)-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-azanyl-2-chloranyl-phenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-amino-2-chloro-phenyl)-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: (5-amino-2-chlorophenyl)-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-amino-2-chlorophenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-amino-2-chloro-phenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C14H21ClN3O+ MolecularWeight: 282.78904

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)N)Cl

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=C(C=CC(=C2)N)Cl

InChI

InChI=1S/C14H20ClN3O/c1-2-5-17-6-8-18(9-7-17)14(19)12-10-11(16)3-4-13(12)15/h3-4,10H,2,5-9,16H2,1H3/p+1