(4-cycloheptylpiperazin-1-yl)-thiophen-2-yl-methanone; ethanedioic acid

Systemtic Name: (4-cycloheptylpiperazin-1-yl)-thiophen-2-yl-methanone; ethanedioic acid Openeye Name: (4-cycloheptylpiperazin-1-yl)-(2-thienyl)methanone; oxalic acid CAS Name: (4-cycloheptyl-1-piperazinyl)-thiophen-2-ylmethanone; oxalic acid IUPAC Name: (4-cycloheptylpiperazin-1-yl)-thiophen-2-ylmethanone; oxalic acid Traditional Name: (4-cycloheptylpiperazino)-(2-thienyl)methanone; oxalic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCC(CC1)N2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24N2OS.C2H2O4/c19-16(15-8-5-13-20-15)18-11-9-17(10-12-18)14-6-3-1-2-4-7-14;3-1(4)2(5)6/h5,8,13-14H,1-4,6-7,9-12H2;(H,3,4)(H,5,6)