N-[2-(azepan-1-ylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)ethanamide; ethanedioic acid

Systemtic Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)ethanamide; ethanedioic acid Openeye Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-N-(4-pyridylmethyl)acetamide; oxalic acid CAS Name: N-[2-(1-azepanylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)acetamide; oxalic acid IUPAC Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)acetamide; oxalic acid Traditional Name: N-[2-(azepan-1-ylsulfonyl)ethyl]-N-(4-pyridylmethyl)acetamide; oxalic acid Formula: C18H27N3O7S MolecularWeight: 429.48788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCS(=O)(=O)N1CCCCCC1)CC2=CC=NC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)N(CCS(=O)(=O)N1CCCCCC1)CC2=CC=NC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25N3O3S.C2H2O4/c1-15(20)18(14-16-6-8-17-9-7-16)12-13-23(21,22)19-10-4-2-3-5-11-19;3-1(4)2(5)6/h6-9H,2-5,10-14H2,1H3;(H,3,4)(H,5,6)