2-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 2-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopropyl-benzamide Formula: C24H30ClN4O3+ MolecularWeight: 457.973

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H29ClN4O3/c25-18-5-9-20(10-6-18)32-16-15-28-11-13-29(14-12-28)17-23(30)27-22-4-2-1-3-21(22)24(31)26-19-7-8-19/h1-6,9-10,19H,7-8,11-17H2,(H,26,31)(H,27,30)/p+1