3-(4-methoxy-1-benzofuran-2-yl)-2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-methoxy-1-benzofuran-2-yl)-2-[(2R)-2-methyl-4-(phenylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propanenitrile Openeye Name: 2-[(2R)-4-benzoyl-2-methyl-piperazin-1-yl]-3-(4-methoxybenzofuran-2-yl)-3-oxo-propanenitrile CAS Name: 2-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-3-(4-methoxy-2-benzofuranyl)-3-oxopropanenitrile IUPAC Name: 2-[(2R)-4-benzoyl-2-methylpiperazin-1-yl]-3-(4-methoxy-1-benzofuran-2-yl)-3-oxopropanenitrile Traditional Name: 2-[(2R)-4-benzoyl-2-methyl-piperazino]-3-keto-3-(4-methoxybenzofuran-2-yl)propionitrile Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C#N)C(=O)C2=CC3=C(O2)C=CC=C3OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(CCN1C(C#N)C(=O)C2=CC3=C(O2)C=CC=C3OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4/c1-16-15-26(24(29)17-7-4-3-5-8-17)11-12-27(16)19(14-25)23(28)22-13-18-20(30-2)9-6-10-21(18)31-22/h3-10,13,16,19H,11-12,15H2,1-2H3/t16-,19?/m1/s1