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

Systemtic Name: 3-[3-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-3-oxidanylidene-propyl]-7-methoxy-4-methyl-chromen-2-one Openeye Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-3-oxo-propyl]-7-methoxy-4-methyl-chromen-2-one CAS Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-3-oxopropyl]-7-methoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl]-7-methoxy-4-methylchromen-2-one Traditional Name: 3-[3-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-3-keto-propyl]-7-methoxy-4-methyl-coumarin Formula: C25H26ClNO5 MolecularWeight: 455.93064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26ClNO5/c1-16-20-8-7-19(31-2)15-22(20)32-24(29)21(16)9-10-23(28)27-13-11-25(30,12-14-27)17-3-5-18(26)6-4-17/h3-8,15,30H,9-14H2,1-2H3