1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)naphthalen-1-yl]pyrrolidin-2-one

Systemtic Name: 1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)naphthalen-1-yl]pyrrolidin-2-one Openeye Name: 1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)-1-naphthyl]pyrrolidin-2-one CAS Name: 1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)-1-naphthalenyl]-2-pyrrolidinone IUPAC Name: 1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)naphthalen-1-yl]pyrrolidin-2-one Traditional Name: 1-[4-(3a,7a-dihydrobenzotriazol-1-ylsulfonyl)-1-naphthyl]-2-pyrrolidone Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C3=CC=CC=C32)S(=O)(=O)N4C5C=CC=CC5N=N4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C3=CC=CC=C32)S(=O)(=O)N4C5C=CC=CC5N=N4

InChI

InChI=1S/C20H18N4O3S/c25-20-10-5-13-23(20)17-11-12-19(15-7-2-1-6-14(15)17)28(26,27)24-18-9-4-3-8-16(18)21-22-24/h1-4,6-9,11-12,16,18H,5,10,13H2