4-bromanyl-5-ethoxy-7-methoxy-1-(4-methylphenyl)sulfonyl-1-benzazepine

Systemtic Name: 4-bromanyl-5-ethoxy-7-methoxy-1-(4-methylphenyl)sulfonyl-1-benzazepine Openeye Name: 4-bromo-5-ethoxy-7-methoxy-1-(p-tolylsulfonyl)-1-benzazepine CAS Name: 4-bromo-5-ethoxy-7-methoxy-1-(4-methylphenyl)sulfonyl-1-benzazepine IUPAC Name: 4-bromo-5-ethoxy-7-methoxy-1-(4-methylphenyl)sulfonyl-1-benzazepine Traditional Name: 4-bromo-5-ethoxy-7-methoxy-1-tosyl-1-benzazepine Formula: C20H20BrNO4S MolecularWeight: 450.3461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CN(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C)Br

Isomeric SMILES

CCOC1=C(C=CN(C2=C1C=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C)Br

InChI

InChI=1S/C20H20BrNO4S/c1-4-26-20-17-13-15(25-3)7-10-19(17)22(12-11-18(20)21)27(23,24)16-8-5-14(2)6-9-16/h5-13H,4H2,1-3H3