5-methyl-1,3-bis(oxidanylidene)-6-(3-phenoxypropoxy)indene-2-carbonitrile

Systemtic Name: 5-methyl-1,3-bis(oxidanylidene)-6-(3-phenoxypropoxy)indene-2-carbonitrile Openeye Name: 5-methyl-1,3-dioxo-6-(3-phenoxypropoxy)indane-2-carbonitrile CAS Name: 5-methyl-1,3-dioxo-6-(3-phenoxypropoxy)-2-indenecarbonitrile IUPAC Name: 5-methyl-1,3-dioxo-6-(3-phenoxypropoxy)indene-2-carbonitrile Traditional Name: 1,3-diketo-5-methyl-6-(3-phenoxypropoxy)indane-2-carbonitrile Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(C2=O)C#N)OCCCOC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(C2=O)C#N)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C20H17NO4/c1-13-10-15-16(20(23)17(12-21)19(15)22)11-18(13)25-9-5-8-24-14-6-3-2-4-7-14/h2-4,6-7,10-11,17H,5,8-9H2,1H3