ethanedioic acid; 1-naphthalen-2-ylsulfonyl-4-propan-2-yl-piperazine

Systemtic Name: ethanedioic acid; 1-naphthalen-2-ylsulfonyl-4-propan-2-yl-piperazine Openeye Name: 1-isopropyl-4-(2-naphthylsulfonyl)piperazine; oxalic acid CAS Name: 1-(2-naphthalenylsulfonyl)-4-propan-2-ylpiperazine; oxalic acid IUPAC Name: 1-naphthalen-2-ylsulfonyl-4-propan-2-ylpiperazine; oxalic acid Traditional Name: 1-isopropyl-4-(2-naphthylsulfonyl)piperazine; oxalic acid Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N2O2S.C2H2O4/c1-14(2)18-9-11-19(12-10-18)22(20,21)17-8-7-15-5-3-4-6-16(15)13-17;3-1(4)2(5)6/h3-8,13-14H,9-12H2,1-2H3;(H,3,4)(H,5,6)