3-chloranyl-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 3-chloranyl-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one Openeye Name: 3-chloro-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one CAS Name: 3-chloro-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one IUPAC Name: 3-chloro-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one Traditional Name: 3-chloro-2-methoxy-5H-benzo[b][1,4]benzothiazepin-6-one Formula: C14H10ClNO2S MolecularWeight: 291.7527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)SC3=CC=CC=C3C(=O)N2)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)SC3=CC=CC=C3C(=O)N2)Cl

InChI

InChI=1S/C14H10ClNO2S/c1-18-11-7-13-10(6-9(11)15)16-14(17)8-4-2-3-5-12(8)19-13/h2-7H,1H3,(H,16,17)