3-[3-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-3-oxidanylidene-propyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one

Systemtic Name: 3-[3-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-3-oxidanylidene-propyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Openeye Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-3-oxo-propyl]-4-methyl-7-(2-methylallyloxy)chromen-2-one CAS Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-3-oxopropyl]-4-methyl-7-(2-methylprop-2-enoxy)-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl]-4-methyl-7-(2-methylprop-2-enoxy)chromen-2-one Traditional Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-3-keto-propyl]-4-methyl-7-(2-methylallyloxy)coumarin Formula: C28H30ClNO5 MolecularWeight: 495.9945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)N3CCC(CC3)(C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)N3CCC(CC3)(C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C28H30ClNO5/c1-18(2)17-34-22-8-9-23-19(3)24(27(32)35-25(23)16-22)10-11-26(31)30-14-12-28(33,13-15-30)20-4-6-21(29)7-5-20/h4-9,16,33H,1,10-15,17H2,2-3H3