(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone

Systemtic Name: (4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone Openeye Name: (4-chloro-3-morpholinosulfonyl-phenyl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone CAS Name: [4-chloro-3-(4-morpholinylsulfonyl)phenyl]-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]methanone IUPAC Name: (4-chloro-3-morpholin-4-ylsulfonylphenyl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone Traditional Name: (4-chloro-3-morpholinosulfonyl-phenyl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone Formula: C24H29ClN2O5S MolecularWeight: 493.01546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H29ClN2O5S/c1-31-20-9-6-18(7-10-20)22-5-3-2-4-12-27(22)24(28)19-8-11-21(25)23(17-19)33(29,30)26-13-15-32-16-14-26/h6-11,17,22H,2-5,12-16H2,1H3/t22-/m1/s1