N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-3-oxidanylidene-benzo[f]chromene-2-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-3-oxidanylidene-benzo[f]chromene-2-carbohydrazide Openeye Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-3-oxo-benzo[f]chromene-2-carbohydrazide CAS Name: N'-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]-3-oxo-2-benzo[f][1]benzopyrancarbohydrazide IUPAC Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-3-oxobenzo[f]chromene-2-carbohydrazide Traditional Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-3-keto-benzo[f]chromene-2-carbohydrazide Formula: C27H25N3O6S MolecularWeight: 519.5689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

InChI

InChI=1S/C27H25N3O6S/c31-25(19-9-12-20(13-10-19)37(34,35)30-15-5-1-2-6-16-30)28-29-26(32)23-17-22-21-8-4-3-7-18(21)11-14-24(22)36-27(23)33/h3-4,7-14,17H,1-2,5-6,15-16H2,(H,28,31)(H,29,32)