3-(3-aminophenyl)-7,9-bis(oxidanyl)-5H-benzo[b][1]benzothiepin-6-one

Systemtic Name: 3-(3-aminophenyl)-7,9-bis(oxidanyl)-5H-benzo[b][1]benzothiepin-6-one Openeye Name: 3-(3-aminophenyl)-7,9-dihydroxy-5H-benzo[b][1]benzothiepin-6-one CAS Name: 3-(3-aminophenyl)-7,9-dihydroxy-5H-benzo[b][1]benzothiepin-6-one IUPAC Name: 3-(3-aminophenyl)-7,9-dihydroxy-5H-benzo[b][1]benzothiepin-6-one Traditional Name: 3-(3-aminophenyl)-7,9-dihydroxy-5H-benzo[b][1]benzothiepin-6-one Formula: C20H15NO3S MolecularWeight: 349.403

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C3=CC(=CC=C3)N)SC4=CC(=CC(=C4C1=O)O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)C3=CC(=CC=C3)N)SC4=CC(=CC(=C4C1=O)O)O

InChI

InChI=1S/C20H15NO3S/c21-14-3-1-2-11(7-14)12-4-5-18-13(6-12)8-16(23)20-17(24)9-15(22)10-19(20)25-18/h1-7,9-10,22,24H,8,21H2