5-[4-(3-phenylpropyl)piperazin-1-yl]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile

Systemtic Name: 5-[4-(3-phenylpropyl)piperazin-1-yl]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 2-isopropyl-5-[4-(3-phenylpropyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 5-[4-(3-phenylpropyl)-1-piperazinyl]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 5-[4-(3-phenylpropyl)piperazin-1-yl]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 2-isopropyl-5-[4-(3-phenylpropyl)piperazino]-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C30H43N3O3 MolecularWeight: 493.68072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCCC2=CC=CC=C2)(C#N)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCCC2=CC=CC=C2)(C#N)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C30H43N3O3/c1-24(2)30(23-31,26-21-27(34-3)29(36-5)28(22-26)35-4)14-10-16-33-19-17-32(18-20-33)15-9-13-25-11-7-6-8-12-25/h6-8,11-12,21-22,24H,9-10,13-20H2,1-5H3