4-[[4-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2,3-dimethyl-2,3-dihydrobenzofuran-7-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(2,3-dimethyl-2,3-dihydrobenzofuran-7-yl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2,3-dimethylcoumaran-7-carbonyl)piperazino]methyl]benzonitrile Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)C

Isomeric SMILES

CC1C(OC2=C(C=CC=C12)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)C

InChI

InChI=1S/C23H25N3O2/c1-16-17(2)28-22-20(16)4-3-5-21(22)23(27)26-12-10-25(11-13-26)15-19-8-6-18(14-24)7-9-19/h3-9,16-17H,10-13,15H2,1-2H3