(2S,3S)-2-methoxy-3-(methoxymethyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine

Systemtic Name: (2S,3S)-2-methoxy-3-(methoxymethyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine Openeye Name: (2S,3S)-2-methoxy-3-(methoxymethyl)-1-(p-tolylsulfonyl)-2,3-dihydro-1-benzazepine CAS Name: (2S,3S)-2-methoxy-3-(methoxymethyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine IUPAC Name: (2S,3S)-2-methoxy-3-(methoxymethyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepine Traditional Name: (2S,3S)-2-methoxy-3-(methoxymethyl)-1-tosyl-2,3-dihydro-1-benzazepine Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C(C=CC3=CC=CC=C32)COC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H]([C@@H](C=CC3=CC=CC=C32)COC)OC

InChI

InChI=1S/C20H23NO4S/c1-15-8-12-18(13-9-15)26(22,23)21-19-7-5-4-6-16(19)10-11-17(14-24-2)20(21)25-3/h4-13,17,20H,14H2,1-3H3/t17-,20-/m0/s1