3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one

Systemtic Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Openeye Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-4-methyl-7-(2-methylallyloxy)chromen-2-one CAS Name: 3-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)-1-benzopyran-2-one IUPAC Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Traditional Name: 3-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C26H27ClN2O4 MolecularWeight: 466.95658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H27ClN2O4/c1-17(2)16-32-21-7-8-22-18(3)23(26(31)33-24(22)14-21)15-25(30)29-11-9-28(10-12-29)20-6-4-5-19(27)13-20/h4-8,13-14H,1,9-12,15-16H2,2-3H3