4-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C23H30ClN4O3S+ MolecularWeight: 478.0273

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H29ClN4O3S/c1-2-26-13-15-27(16-14-26)21-8-4-3-7-20(21)25-23(29)18-9-10-19(24)22(17-18)32(30,31)28-11-5-6-12-28/h3-4,7-10,17H,2,5-6,11-16H2,1H3,(H,25,29)/p+1