N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(6-chloranyl-4-oxidanylidene-2-phenyl-chromen-3-yl)oxy-ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(6-chloranyl-4-oxidanylidene-2-phenyl-chromen-3-yl)oxy-ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(6-chloro-4-oxo-2-phenyl-chromen-3-yl)oxy-acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[(6-chloro-4-oxo-2-phenyl-1-benzopyran-3-yl)oxy]acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(6-chloro-4-oxo-2-phenylchromen-3-yl)oxyacetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(6-chloro-4-keto-2-phenyl-chromen-3-yl)oxy-acetamide Formula: C29H27ClN2O6S MolecularWeight: 567.05248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=C(OC4=C(C3=O)C=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=C(OC4=C(C3=O)C=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C29H27ClN2O6S/c30-21-10-15-25-24(18-21)27(34)29(28(38-25)20-8-4-3-5-9-20)37-19-26(33)31-22-11-13-23(14-12-22)39(35,36)32-16-6-1-2-7-17-32/h3-5,8-15,18H,1-2,6-7,16-17,19H2,(H,31,33)