1-[2-[4-(4-ethylphenyl)piperazin-1-ium-1-yl]ethyl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[2-[4-(4-ethylphenyl)piperazin-1-ium-1-yl]ethyl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[2-[4-(4-ethylphenyl)piperazin-1-ium-1-yl]ethyl]-3-(4-methoxyphenyl)urea CAS Name: 1-[2-[4-(4-ethylphenyl)-1-piperazin-1-iumyl]ethyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[2-[4-(4-ethylphenyl)piperazin-1-ium-1-yl]ethyl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[2-[4-(4-ethylphenyl)piperazin-1-ium-1-yl]ethyl]-3-(4-methoxyphenyl)urea Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC[NH+](CC2)CCNC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)N2CC[NH+](CC2)CCNC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N4O2/c1-3-18-4-8-20(9-5-18)26-16-14-25(15-17-26)13-12-23-22(27)24-19-6-10-21(28-2)11-7-19/h4-11H,3,12-17H2,1-2H3,(H2,23,24,27)/p+1