3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-oxo-propanenitrile CAS Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-oxopropanenitrile IUPAC Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-oxopropanenitrile Traditional Name: 3-[4-(13,13-dimethyltetradecylamino)phenyl]-3-keto-propionitrile Formula: C25H40N2O MolecularWeight: 384.5979

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)CC#N

Isomeric SMILES

CC(C)(C)CCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)CC#N

InChI

InChI=1S/C25H40N2O/c1-25(2,3)19-12-10-8-6-4-5-7-9-11-13-21-27-23-16-14-22(15-17-23)24(28)18-20-26/h14-17,27H,4-13,18-19,21H2,1-3H3