N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-5-nitro-benzothiophene-2-carboxamide Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])CC2OC(=C1)O

InChI

InChI=1S/C19H16N2O5S/c1-10-6-18(22)26-15-9-12(2-4-14(10)15)20-19(23)17-8-11-7-13(21(24)25)3-5-16(11)27-17/h3,5-8,15,22H,2,4,9H2,1H3