N-[(2-methoxyphenyl)methyl]-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-[(2-methoxyphenyl)methyl]-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-o-anisyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C15H24N3O4S+ MolecularWeight: 342.43376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H23N3O4S/c1-22-14-5-3-2-4-13(14)12-17-15(19)6-11-23(20,21)18-9-7-16-8-10-18/h2-5,16H,6-12H2,1H3,(H,17,19)/p+1