1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(diethylamino)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(diethylamino)propan-2-ol; ethanedioic acid Openeye Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(diethylamino)propan-2-ol; oxalic acid CAS Name: 1-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-3-(diethylamino)-2-propanol; oxalic acid IUPAC Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(diethylamino)propan-2-ol; oxalic acid Traditional Name: 1-[4-(4-chlorophenyl)sulfonylpiperazino]-3-(diethylamino)propan-2-ol; oxalic acid Formula: C19H30ClN3O7S MolecularWeight: 479.9754

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC(CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H28ClN3O3S.C2H2O4/c1-3-19(4-2)13-16(22)14-20-9-11-21(12-10-20)25(23,24)17-7-5-15(18)6-8-17;3-1(4)2(5)6/h5-8,16,22H,3-4,9-14H2,1-2H3;(H,3,4)(H,5,6)