N-cyclopropyl-2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H29N4O4S+ MolecularWeight: 493.59786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H28N4O4S/c31-25(28-24-8-4-3-7-23(24)26(32)27-21-10-11-21)18-29-13-15-30(16-14-29)35(33,34)22-12-9-19-5-1-2-6-20(19)17-22/h1-9,12,17,21H,10-11,13-16,18H2,(H,27,32)(H,28,31)/p+1