(2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-cyclopropyl-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C16H22Cl2N3O3S+ MolecularWeight: 407.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C(=O)NC1CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H21Cl2N3O3S/c1-11(16(22)19-12-2-3-12)20-6-8-21(9-7-20)25(23,24)13-4-5-14(17)15(18)10-13/h4-5,10-12H,2-3,6-9H2,1H3,(H,19,22)/p+1/t11-/m1/s1