2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]heptanenitrile

Systemtic Name: 2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]heptanenitrile Openeye Name: 2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]heptanenitrile CAS Name: 2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]heptanenitrile IUPAC Name: 2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]heptanenitrile Traditional Name: 2-cyclobutyl-2-(3,4-dichlorophenyl)-5-[phenethyl(propyl)amino]enanthonitrile Formula: C28H36Cl2N2 MolecularWeight: 471.50484

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC1=CC=CC=C1)C(CC)CCC(C#N)(C2CCC2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCN(CCC1=CC=CC=C1)C(CC)CCC(C#N)(C2CCC2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C28H36Cl2N2/c1-3-18-32(19-16-22-9-6-5-7-10-22)25(4-2)15-17-28(21-31,23-11-8-12-23)24-13-14-26(29)27(30)20-24/h5-7,9-10,13-14,20,23,25H,3-4,8,11-12,15-19H2,1-2H3