N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-benzyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(phenylmethyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-benzyl-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-benzyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C14H21N3O3S/c18-14(16-12-13-4-2-1-3-5-13)6-11-21(19,20)17-9-7-15-8-10-17/h1-5,15H,6-12H2,(H,16,18)/p+1