1-[2-(4-methoxyphenyl)azepan-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-[2-(4-methoxyphenyl)azepan-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one Openeye Name: 1-[2-(4-methoxyphenyl)azepan-1-yl]-3-(4-morpholinosulfonylphenyl)propan-1-one CAS Name: 1-[2-(4-methoxyphenyl)-1-azepanyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-[2-(4-methoxyphenyl)azepan-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)propan-1-one Traditional Name: 1-[2-(4-methoxyphenyl)azepan-1-yl]-3-(4-morpholinosulfonylphenyl)propan-1-one Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H34N2O5S/c1-32-23-11-9-22(10-12-23)25-5-3-2-4-16-28(25)26(29)15-8-21-6-13-24(14-7-21)34(30,31)27-17-19-33-20-18-27/h6-7,9-14,25H,2-5,8,15-20H2,1H3