2-azanyl-5-oxidanylidene-6H-benzo[b][1]benzothiepine-9-carboxylic acid

Systemtic Name: 2-azanyl-5-oxidanylidene-6H-benzo[b][1]benzothiepine-9-carboxylic acid Openeye Name: 2-amino-5-oxo-6H-benzo[b][1]benzothiepine-9-carboxylic acid CAS Name: 2-amino-5-oxo-6H-benzo[b][1]benzothiepin-9-carboxylic acid IUPAC Name: 2-amino-5-oxo-6H-benzo[b][1]benzothiepine-9-carboxylic acid Traditional Name: 2-amino-5-keto-6H-benzo[b][1]benzothiepin-9-carboxylic acid Formula: C15H11NO3S MolecularWeight: 285.31774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)O)SC3=C(C1=O)C=CC(=C3)N

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)O)SC3=C(C1=O)C=CC(=C3)N

InChI

InChI=1S/C15H11NO3S/c16-10-3-4-11-12(17)5-8-1-2-9(15(18)19)6-13(8)20-14(11)7-10/h1-4,6-7H,5,16H2,(H,18,19)