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methyl 2-[(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

methyl 2-[(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name:methyl 2-[(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Openeye Name:methyl 2-[(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name:2-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester
IUPAC Name:methyl 2-[(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Traditional Name:2-[(6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester
Formula: C17H16N2O5S
MolecularWeight: 360.38434
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)NC=C3C=CC=C(C3=O)[N+](=O)[O-]


Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)NC=C3C=CC=C(C3=O)[N+](=O)[O-]


InChI

InChI=1S/C17H16N2O5S/c1-24-17(21)14-11-6-2-3-8-13(11)25-16(14)18-9-10-5-4-7-12(15(10)20)19(22)23/h4-5,7,9,18H,2-3,6,8H2,1H3


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