2-[5-(1-cyanoethoxy)-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanenitrile

Systemtic Name: 2-[5-(1-cyanoethoxy)-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanenitrile Openeye Name: 2-[3-benzyl-5-(1-cyanoethoxy)-4-methyl-2-oxo-chromen-7-yl]oxypropanenitrile CAS Name: 2-[[5-(1-cyanoethoxy)-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]propanenitrile IUPAC Name: 2-[3-benzyl-5-(1-cyanoethoxy)-4-methyl-2-oxochromen-7-yl]oxypropanenitrile Traditional Name: 2-[3-benzyl-5-(1-cyanoethoxy)-2-keto-4-methyl-chromen-7-yl]oxypropionitrile Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)OC(C)C#N)OC(C)C#N)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)OC(C)C#N)OC(C)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C23H20N2O4/c1-14(12-24)27-18-10-20(28-15(2)13-25)22-16(3)19(23(26)29-21(22)11-18)9-17-7-5-4-6-8-17/h4-8,10-11,14-15H,9H2,1-3H3