4-[[(3-azanyl-2,2-dimethyl-propyl)-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(3-azanyl-2,2-dimethyl-propyl)-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(3-amino-2,2-dimethyl-propyl)-[(4-benzyloxy-3-methoxy-phenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[(3-amino-2,2-dimethylpropyl)-[(3-methoxy-4-phenylmethoxyphenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[(3-amino-2,2-dimethylpropyl)-[(3-methoxy-4-phenylmethoxyphenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[(3-amino-2,2-dimethyl-propyl)-(4-benzoxy-3-methoxy-benzyl)amino]methyl]benzonitrile Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC=C(C=C1)C#N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)(CN)CN(CC1=CC=C(C=C1)C#N)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C28H33N3O2/c1-28(2,20-30)21-31(17-23-11-9-22(16-29)10-12-23)18-25-13-14-26(27(15-25)32-3)33-19-24-7-5-4-6-8-24/h4-15H,17-21,30H2,1-3H3