3,3-dicyano-2-[4-(dihexylamino)phenyl]prop-2-enoic acid

Systemtic Name: 3,3-dicyano-2-[4-(dihexylamino)phenyl]prop-2-enoic acid Openeye Name: 3,3-dicyano-2-[4-(dihexylamino)phenyl]prop-2-enoic acid CAS Name: 3,3-dicyano-2-[4-(dihexylamino)phenyl]-2-propenoic acid IUPAC Name: 3,3-dicyano-2-[4-(dihexylamino)phenyl]prop-2-enoic acid Traditional Name: 3,3-dicyano-2-[4-(dihexylamino)phenyl]acrylic acid Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC=C(C=C1)C(=C(C#N)C#N)C(=O)O

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC=C(C=C1)C(=C(C#N)C#N)C(=O)O

InChI

InChI=1S/C23H31N3O2/c1-3-5-7-9-15-26(16-10-8-6-4-2)21-13-11-19(12-14-21)22(23(27)28)20(17-24)18-25/h11-14H,3-10,15-16H2,1-2H3,(H,27,28)