3-(2,3,4-trimethoxy-6-oxidanylidene-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanenitrile

Systemtic Name: 3-(2,3,4-trimethoxy-6-oxidanylidene-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanenitrile Openeye Name: 3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanenitrile CAS Name: 3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanenitrile IUPAC Name: 3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanenitrile Traditional Name: 3-(6-keto-2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzocyclohepten-5-yl)propionitrile Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(C(=O)CCCC2=C1)CCC#N)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(C(=O)CCCC2=C1)CCC#N)OC)OC

InChI

InChI=1S/C17H21NO4/c1-20-14-10-11-6-4-8-13(19)12(7-5-9-18)15(11)17(22-3)16(14)21-2/h10,12H,4-8H2,1-3H3