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

Systemtic Name: N'-[(3-methoxy-4-oxidanylidene-5-prop-2-enyl-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-[(3-allyl-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide CAS Name: N'-[(3-methoxy-4-oxo-5-prop-2-enyl-1-cyclohexa-2,5-dienylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-[(3-methoxy-4-oxo-5-prop-2-enylcyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-[(3-allyl-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-5-nitro-benzothiophene-2-carbohydrazide Formula: C20H17N3O5S MolecularWeight: 411.43108

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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=C(C1=O)CC=C

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C=C(C1=O)CC=C

InChI

InChI=1S/C20H17N3O5S/c1-3-4-13-7-12(8-16(28-2)19(13)24)11-21-22-20(25)18-10-14-9-15(23(26)27)5-6-17(14)29-18/h3,5-11,21H,1,4H2,2H3,(H,22,25)