2,2-dimethyl-4-(2-oxidanylideneazepan-1-yl)chromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-(2-oxidanylideneazepan-1-yl)chromene-6-carbonitrile Openeye Name: 2,2-dimethyl-4-(2-oxoazepan-1-yl)chromene-6-carbonitrile CAS Name: 2,2-dimethyl-4-(2-oxo-1-azepanyl)-1-benzopyran-6-carbonitrile IUPAC Name: 2,2-dimethyl-4-(2-oxoazepan-1-yl)chromene-6-carbonitrile Traditional Name: 4-(2-ketoazepan-1-yl)-2,2-dimethyl-chromene-6-carbonitrile Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3CCCCCC3=O)C

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)N3CCCCCC3=O)C

InChI

InChI=1S/C18H20N2O2/c1-18(2)11-15(20-9-5-3-4-6-17(20)21)14-10-13(12-19)7-8-16(14)22-18/h7-8,10-11H,3-6,9H2,1-2H3