N-[(1R)-2-azanyl-1-phenyl-ethyl]-2-cyclohexa-1,4-dien-1-yl-ethanesulfonamide

Systemtic Name: N-[(1R)-2-azanyl-1-phenyl-ethyl]-2-cyclohexa-1,4-dien-1-yl-ethanesulfonamide Openeye Name: N-[(1R)-2-amino-1-phenyl-ethyl]-2-cyclohexa-1,4-dien-1-yl-ethanesulfonamide CAS Name: N-[(1R)-2-amino-1-phenylethyl]-2-(1-cyclohexa-1,4-dienyl)ethanesulfonamide IUPAC Name: N-[(1R)-2-amino-1-phenylethyl]-2-cyclohexa-1,4-dien-1-ylethanesulfonamide Traditional Name: N-[(1R)-2-amino-1-phenyl-ethyl]-2-cyclohexa-1,4-dien-1-yl-ethanesulfonamide Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(=C1)CCS(=O)(=O)NC(CN)C2=CC=CC=C2

Isomeric SMILES

C1C=CCC(=C1)CCS(=O)(=O)N[C@@H](CN)C2=CC=CC=C2

InChI

InChI=1S/C16H22N2O2S/c17-13-16(15-9-5-2-6-10-15)18-21(19,20)12-11-14-7-3-1-4-8-14/h1-3,5-6,8-10,16,18H,4,7,11-13,17H2/t16-/m0/s1