2-azanyl-4-[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[5-(4-chloro-3-nitro-phenyl)-2-furyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[5-(4-chloro-3-nitrophenyl)-2-furanyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[5-(4-chloro-3-nitro-phenyl)-2-furyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C22H18ClN3O5 MolecularWeight: 439.84842

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C22H18ClN3O5/c1-22(2)8-15(27)20-18(9-22)31-21(25)12(10-24)19(20)17-6-5-16(30-17)11-3-4-13(23)14(7-11)26(28)29/h3-7,19H,8-9,25H2,1-2H3