N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzamide Openeye Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3,4-dimethylbenzamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethylbenzamide Traditional Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzamide Formula: C21H27ClN3O+ MolecularWeight: 372.91158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)C)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)C)Cl

InChI

InChI=1S/C21H26ClN3O/c1-4-24-9-11-25(12-10-24)20-8-7-18(14-19(20)22)23-21(26)17-6-5-15(2)16(3)13-17/h5-8,13-14H,4,9-12H2,1-3H3,(H,23,26)/p+1