3-azanyl-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 3-azanyl-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-propan-2-yl-pentanenitrile Openeye Name: 3-amino-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-isopropyl-pentanenitrile CAS Name: 3-amino-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-propan-2-ylpentanenitrile IUPAC Name: 3-amino-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-propan-2-ylpentanenitrile Traditional Name: 3-amino-2,5-bis(3,4-dimethoxyphenyl)-3-ethyl-2-isopropyl-valeronitrile Formula: C26H36N2O4 MolecularWeight: 440.57504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC(=C(C=C1)OC)OC)(C(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C)N

Isomeric SMILES

CCC(CCC1=CC(=C(C=C1)OC)OC)(C(C#N)(C2=CC(=C(C=C2)OC)OC)C(C)C)N

InChI

InChI=1S/C26H36N2O4/c1-8-25(28,14-13-19-9-11-21(29-4)23(15-19)31-6)26(17-27,18(2)3)20-10-12-22(30-5)24(16-20)32-7/h9-12,15-16,18H,8,13-14,28H2,1-7H3