3-[[4-(3,4-dimethoxy-2-phenylmethoxy-phenyl)-3-methyl-4-oxidanylidene-but-2-en-2-yl]amino]propanenitrile

Systemtic Name: 3-[[4-(3,4-dimethoxy-2-phenylmethoxy-phenyl)-3-methyl-4-oxidanylidene-but-2-en-2-yl]amino]propanenitrile Openeye Name: 3-[[3-(2-benzyloxy-3,4-dimethoxy-phenyl)-1,2-dimethyl-3-oxo-prop-1-enyl]amino]propanenitrile CAS Name: 3-[[4-(3,4-dimethoxy-2-phenylmethoxyphenyl)-3-methyl-4-oxobut-2-en-2-yl]amino]propanenitrile IUPAC Name: 3-[[4-(3,4-dimethoxy-2-phenylmethoxyphenyl)-3-methyl-4-oxobut-2-en-2-yl]amino]propanenitrile Traditional Name: 3-[[3-(2-benzoxy-3,4-dimethoxy-phenyl)-3-keto-1,2-dimethyl-prop-1-enyl]amino]propionitrile Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)NCCC#N)C(=O)C1=C(C(=C(C=C1)OC)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC(=C(C)NCCC#N)C(=O)C1=C(C(=C(C=C1)OC)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C23H26N2O4/c1-16(17(2)25-14-8-13-24)21(26)19-11-12-20(27-3)23(28-4)22(19)29-15-18-9-6-5-7-10-18/h5-7,9-12,25H,8,14-15H2,1-4H3