2-chloranyl-4-piperazin-4-ium-1-yl-N-propan-2-yl-benzamide

Systemtic Name: 2-chloranyl-4-piperazin-4-ium-1-yl-N-propan-2-yl-benzamide Openeye Name: 2-chloro-N-isopropyl-4-piperazin-4-ium-1-yl-benzamide CAS Name: 2-chloro-4-(1-piperazin-4-iumyl)-N-propan-2-ylbenzamide IUPAC Name: 2-chloro-4-piperazin-4-ium-1-yl-N-propan-2-ylbenzamide Traditional Name: 2-chloro-N-isopropyl-4-piperazin-4-ium-1-yl-benzamide Formula: C14H21ClN3O+ MolecularWeight: 282.78904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=C(C=C1)N2CC[NH2+]CC2)Cl

Isomeric SMILES

CC(C)NC(=O)C1=C(C=C(C=C1)N2CC[NH2+]CC2)Cl

InChI

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