N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide

Systemtic Name: N'-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide CAS Name: N'-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C=CC1=O

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C=CC1=O

InChI

InChI=1S/C17H13N3O5S/c1-25-14-6-10(2-4-13(14)21)9-18-19-17(22)16-8-11-7-12(20(23)24)3-5-15(11)26-16/h2-9,18H,1H3,(H,19,22)