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3-[methyl-[3-[3-methyl-4-(2-methylpropanoyl)phenyl]prop-2-ynyl]amino]benzenecarbonitrile

3-[methyl-[3-[3-methyl-4-(2-methylpropanoyl)phenyl]prop-2-ynyl]amino]benzenecarbonitrile

Systemtic Name:3-[methyl-[3-[3-methyl-4-(2-methylpropanoyl)phenyl]prop-2-ynyl]amino]benzenecarbonitrile
Openeye Name:3-[methyl-[3-[3-methyl-4-(2-methylpropanoyl)phenyl]prop-2-ynyl]amino]benzonitrile
CAS Name:3-[methyl-[3-[3-methyl-4-(2-methyl-1-oxopropyl)phenyl]prop-2-ynyl]amino]benzonitrile
IUPAC Name:3-[methyl-[3-[3-methyl-4-(2-methylpropanoyl)phenyl]prop-2-ynyl]amino]benzonitrile
Traditional Name:3-[3-(4-isobutyryl-3-methyl-phenyl)prop-2-ynyl-methyl-amino]benzonitrile
Formula: C22H22N2O
MolecularWeight: 330.42288
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C#N)C(=O)C(C)C


Isomeric SMILES

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C#N)C(=O)C(C)C


InChI

InChI=1S/C22H22N2O/c1-16(2)22(25)21-11-10-18(13-17(21)3)8-6-12-24(4)20-9-5-7-19(14-20)15-23/h5,7,9-11,13-14,16H,12H2,1-4H3


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