(2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-cyclopropyl-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C(=O)NC3CC3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)NC3CC3

InChI

InChI=1S/C19H29N3O3S/c1-3-4-16-5-9-18(10-6-16)26(24,25)22-13-11-21(12-14-22)15(2)19(23)20-17-7-8-17/h5-6,9-10,15,17H,3-4,7-8,11-14H2,1-2H3,(H,20,23)/p+1/t15-/m1/s1