1-[4-(phenylsulfonyl)naphthalen-1-yl]-1,4-diazepane

Systemtic Name: 1-[4-(phenylsulfonyl)naphthalen-1-yl]-1,4-diazepane Openeye Name: 1-[4-(benzenesulfonyl)-1-naphthyl]-1,4-diazepane CAS Name: 1-[4-(benzenesulfonyl)-1-naphthalenyl]-1,4-diazepane IUPAC Name: 1-[4-(benzenesulfonyl)naphthalen-1-yl]-1,4-diazepane Traditional Name: 1-(4-besyl-1-naphthyl)-1,4-diazepane Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCCN(C1)C2=CC=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c24-26(25,17-7-2-1-3-8-17)21-12-11-20(18-9-4-5-10-19(18)21)23-15-6-13-22-14-16-23/h1-5,7-12,22H,6,13-16H2