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

Systemtic Name: 2-azanyl-4-(5-butyl-4-nitro-thiophen-2-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(5-butyl-4-nitro-2-thienyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(5-butyl-4-nitro-2-thiophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(5-butyl-4-nitrothiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(5-butyl-4-nitro-2-thienyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(S1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=C(C=C(S1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4S/c1-4-5-6-15-12(23(25)26)7-16(28-15)17-11(10-21)19(22)27-14-9-20(2,3)8-13(24)18(14)17/h7,17H,4-6,8-9,22H2,1-3H3