N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-4-(4-methylphenyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-4-(4-methylphenyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]propyl]-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C30H30FN3O3 MolecularWeight: 499.575903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCCN4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCCN4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C30H30FN3O3/c1-21-11-13-22(14-12-21)27-23-7-2-3-8-24(23)30(36)37-28(27)29(35)32-15-6-16-33-17-19-34(20-18-33)26-10-5-4-9-25(26)31/h2-5,7-14H,6,15-20H2,1H3,(H,32,35)