3-[(E)-N-ethoxy-C-methyl-carbonimidoyl]-5,6-dihydrobenzo[b][1]benzothiepine-7,9-diol

Systemtic Name: 3-[(E)-N-ethoxy-C-methyl-carbonimidoyl]-5,6-dihydrobenzo[b][1]benzothiepine-7,9-diol Openeye Name: 3-[(E)-N-ethoxy-C-methyl-carbonimidoyl]-5,6-dihydrobenzo[b][1]benzothiepine-7,9-diol CAS Name: 3-[(1E)-1-ethoxyiminoethyl]-5,6-dihydrobenzo[b][1]benzothiepin-7,9-diol IUPAC Name: 3-[(E)-N-ethoxy-C-methylcarbonimidoyl]-5,6-dihydrobenzo[b][1]benzothiepine-7,9-diol Traditional Name: 3-[(E)-N-ethoxy-C-methyl-carbonimidoyl]-5,6-dihydrobenzo[b][1]benzothiepin-7,9-diol Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C)C1=CC2=C(C=C1)SC3=CC(=CC(=C3CC2)O)O

Isomeric SMILES

CCO/N=C(\C)/C1=CC2=C(C=C1)SC3=CC(=CC(=C3CC2)O)O

InChI

InChI=1S/C18H19NO3S/c1-3-22-19-11(2)12-5-7-17-13(8-12)4-6-15-16(21)9-14(20)10-18(15)23-17/h5,7-10,20-21H,3-4,6H2,1-2H3/b19-11+