2-azanyl-7,7-dimethyl-4-(5-nitrothiophen-2-yl)-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-7,7-dimethyl-4-(5-nitrothiophen-2-yl)-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-7,7-dimethyl-4-(5-nitro-2-thienyl)-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-4-(5-nitro-2-thiophenyl)-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-4-(5-nitrothiophen-2-yl)-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-5-keto-7,7-dimethyl-4-(5-nitro-2-thienyl)-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(S3)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(S3)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C16H15N3O4S/c1-16(2)5-9(20)14-10(6-16)23-15(18)8(7-17)13(14)11-3-4-12(24-11)19(21)22/h3-4,13H,5-6,18H2,1-2H3