N-[4-(azepan-1-ylsulfonyl)phenyl]-6,8-bis(chloranyl)-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-6,8-bis(chloranyl)-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-6,8-dichloro-4-oxo-chromene-2-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-6,8-dichloro-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-6,8-dichloro-4-oxochromene-2-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-6,8-dichloro-4-keto-chromene-2-carboxamide Formula: C22H20Cl2N2O5S MolecularWeight: 495.3756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O5S/c23-14-11-17-19(27)13-20(31-21(17)18(24)12-14)22(28)25-15-5-7-16(8-6-15)32(29,30)26-9-3-1-2-4-10-26/h5-8,11-13H,1-4,9-10H2,(H,25,28)