2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-(undecylamino)pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-(undecylamino)pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(undecylamino)pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-(undecylamino)pentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-propan-2-yl-5-(undecylamino)pentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(undecylamino)valeronitrile Formula: C27H46N2O2 MolecularWeight: 430.66634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNCCCC(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C

Isomeric SMILES

CCCCCCCCCCCNCCCC(C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C

InChI

InChI=1S/C27H46N2O2/c1-6-7-8-9-10-11-12-13-14-19-29-20-15-18-27(22-28,23(2)3)24-16-17-25(30-4)26(21-24)31-5/h16-17,21,23,29H,6-15,18-20H2,1-5H3