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

Systemtic Name: 1-[2-[4-(4-butoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carboxamide Openeye Name: 1-[2-[4-(4-butoxyphenyl)piperazin-1-yl]ethyl]isochromane-6-carboxamide CAS Name: 1-[2-[4-(4-butoxyphenyl)-1-piperazinyl]ethyl]-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: 1-[2-[4-(4-butoxyphenyl)piperazin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carboxamide Traditional Name: 1-[2-[4-(4-butoxyphenyl)piperazino]ethyl]isochroman-6-carboxamide Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)C(=O)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)C(=O)N

InChI

InChI=1S/C26H35N3O3/c1-2-3-17-31-23-7-5-22(6-8-23)29-15-13-28(14-16-29)12-10-25-24-9-4-21(26(27)30)19-20(24)11-18-32-25/h4-9,19,25H,2-3,10-18H2,1H3,(H2,27,30)