2-chloranyl-N-cyclopropyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-cyclopropyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-cyclopropyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-cyclopropyl-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-cyclopropyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-cyclopropyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C16H23ClN3O3S+ MolecularWeight: 372.89012

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CC3

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CC3

InChI

InChI=1S/C16H22ClN3O3S/c1-2-19-7-9-20(10-8-19)24(22,23)13-5-6-15(17)14(11-13)16(21)18-12-3-4-12/h5-6,11-12H,2-4,7-10H2,1H3,(H,18,21)/p+1