N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propionamide Formula: C22H29ClN3O2+ MolecularWeight: 402.93756

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28ClN3O2/c1-3-25-12-14-26(15-13-25)21-10-7-18(23)16-20(21)24-22(27)11-6-17-4-8-19(28-2)9-5-17/h4-5,7-10,16H,3,6,11-15H2,1-2H3,(H,24,27)/p+1