4-[3-oxidanylidene-3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]propyl]benzenecarbonitrile

Systemtic Name: 4-[3-oxidanylidene-3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]propyl]benzenecarbonitrile Openeye Name: 4-[3-oxo-3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]propyl]benzonitrile CAS Name: 4-[3-oxo-3-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]propyl]benzonitrile IUPAC Name: 4-[3-oxo-3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]propyl]benzonitrile Traditional Name: 4-[3-keto-3-[4-(2,3,4-trimethoxybenzyl)piperazino]propyl]benzonitrile Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)CCC3=CC=C(C=C3)C#N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)CCC3=CC=C(C=C3)C#N)OC)OC

InChI

InChI=1S/C24H29N3O4/c1-29-21-10-9-20(23(30-2)24(21)31-3)17-26-12-14-27(15-13-26)22(28)11-8-18-4-6-19(16-25)7-5-18/h4-7,9-10H,8,11-15,17H2,1-3H3