[4-(4-methanoylpiperazin-1-yl)sulfonylphenyl]methyl-propan-2-yl-azanium

Systemtic Name: [4-(4-methanoylpiperazin-1-yl)sulfonylphenyl]methyl-propan-2-yl-azanium Openeye Name: [4-(4-formylpiperazin-1-yl)sulfonylphenyl]methyl-isopropyl-ammonium CAS Name: [4-[(4-formyl-1-piperazinyl)sulfonyl]phenyl]methyl-propan-2-ylammonium IUPAC Name: [4-(4-formylpiperazin-1-yl)sulfonylphenyl]methyl-propan-2-ylazanium Traditional Name: [4-(4-formylpiperazino)sulfonylbenzyl]-isopropyl-ammonium Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C=O

Isomeric SMILES

CC(C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C=O

InChI

InChI=1S/C15H23N3O3S/c1-13(2)16-11-14-3-5-15(6-4-14)22(20,21)18-9-7-17(12-19)8-10-18/h3-6,12-13,16H,7-11H2,1-2H3/p+1