1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carbonitrile

Systemtic Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carbonitrile Openeye Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]isochromane-6-carbonitrile CAS Name: 1-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-3,4-dihydro-1H-2-benzopyran-6-carbonitrile IUPAC Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carbonitrile Traditional Name: 1-[2-[4-(4-methoxyphenyl)piperazino]ethyl]isochroman-6-carbonitrile Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)C#N

InChI

InChI=1S/C23H27N3O2/c1-27-21-5-3-20(4-6-21)26-13-11-25(12-14-26)10-8-23-22-7-2-18(17-24)16-19(22)9-15-28-23/h2-7,16,23H,8-15H2,1H3