3-methoxy-4-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butoxy]benzenecarbonitrile

Systemtic Name: 3-methoxy-4-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butoxy]benzenecarbonitrile Openeye Name: 3-methoxy-4-[4-[4-(o-tolylmethyl)piperazin-1-yl]-4-oxo-butoxy]benzonitrile CAS Name: 3-methoxy-4-[4-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-4-oxobutoxy]benzonitrile IUPAC Name: 3-methoxy-4-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxobutoxy]benzonitrile Traditional Name: 4-[4-keto-4-[4-(2-methylbenzyl)piperazino]butoxy]-3-methoxy-benzonitrile Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C24H29N3O3/c1-19-6-3-4-7-21(19)18-26-11-13-27(14-12-26)24(28)8-5-15-30-22-10-9-20(17-25)16-23(22)29-2/h3-4,6-7,9-10,16H,5,8,11-15,18H2,1-2H3