4-[[1-(3-methoxyphenyl)-2-[4-(2-phenylmethoxyethanoyl)piperazin-1-yl]ethoxy]methyl]benzenecarbonitrile

Systemtic Name: 4-[[1-(3-methoxyphenyl)-2-[4-(2-phenylmethoxyethanoyl)piperazin-1-yl]ethoxy]methyl]benzenecarbonitrile Openeye Name: 4-[[2-[4-(2-benzyloxyacetyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy]methyl]benzonitrile CAS Name: 4-[[1-(3-methoxyphenyl)-2-[4-(1-oxo-2-phenylmethoxyethyl)-1-piperazinyl]ethoxy]methyl]benzonitrile IUPAC Name: 4-[[1-(3-methoxyphenyl)-2-[4-(2-phenylmethoxyacetyl)piperazin-1-yl]ethoxy]methyl]benzonitrile Traditional Name: 4-[[2-[4-(2-benzoxyacetyl)piperazino]-1-(3-methoxyphenyl)ethoxy]methyl]benzonitrile Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CN2CCN(CC2)C(=O)COCC3=CC=CC=C3)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(CN2CCN(CC2)C(=O)COCC3=CC=CC=C3)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C30H33N3O4/c1-35-28-9-5-8-27(18-28)29(37-22-26-12-10-24(19-31)11-13-26)20-32-14-16-33(17-15-32)30(34)23-36-21-25-6-3-2-4-7-25/h2-13,18,29H,14-17,20-23H2,1H3