[4-(azepan-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone; ethanedioic acid

Systemtic Name: [4-(azepan-1-yl)piperidin-1-yl]-thiophen-2-yl-methanone; ethanedioic acid Openeye Name: [4-(azepan-1-yl)-1-piperidyl]-(2-thienyl)methanone; oxalic acid CAS Name: [4-(1-azepanyl)-1-piperidinyl]-thiophen-2-ylmethanone; oxalic acid IUPAC Name: [4-(azepan-1-yl)piperidin-1-yl]-thiophen-2-ylmethanone; oxalic acid Traditional Name: [4-(azepan-1-yl)piperidino]-(2-thienyl)methanone; oxalic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)C2CCN(CC2)C(=O)C3=CC=CS3.C(=O)(C(=O)O)O

InChI

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