4-[2-(1,2-dihydroacenaphthylen-1-ylsulfonyl)ethyl]pyridine; ethanoic acid

Systemtic Name: 4-[2-(1,2-dihydroacenaphthylen-1-ylsulfonyl)ethyl]pyridine; ethanoic acid Openeye Name: acetic acid; 4-[2-(1,2-dihydroacenaphthylen-1-ylsulfonyl)ethyl]pyridine CAS Name: acetic acid; 4-[2-(1,2-dihydroacenaphthylen-1-ylsulfonyl)ethyl]pyridine IUPAC Name: acetic acid; 4-[2-(1,2-dihydroacenaphthylen-1-ylsulfonyl)ethyl]pyridine Traditional Name: 4-(2-acenaphthen-1-ylsulfonylethyl)pyridine; acetic acid Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1C(C2=CC=CC3=C2C1=CC=C3)S(=O)(=O)CCC4=CC=NC=C4

Isomeric SMILES

CC(=O)O.C1C(C2=CC=CC3=C2C1=CC=C3)S(=O)(=O)CCC4=CC=NC=C4

InChI

InChI=1S/C19H17NO2S.C2H4O2/c21-23(22,12-9-14-7-10-20-11-8-14)18-13-16-5-1-3-15-4-2-6-17(18)19(15)16;1-2(3)4/h1-8,10-11,18H,9,12-13H2;1H3,(H,3,4)