3-(2-methylphenyl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one

Systemtic Name: 3-(2-methylphenyl)-7-oxidanyl-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Openeye Name: 7-hydroxy-3-(o-tolyl)-4-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]chromen-2-one CAS Name: 7-hydroxy-3-(2-methylphenyl)-4-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3-(2-methylphenyl)-4-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]chromen-2-one Traditional Name: 7-hydroxy-3-(o-tolyl)-4-[4-(2-piperidinoethoxy)benzyl]coumarin Formula: C30H31NO4 MolecularWeight: 469.57144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C3=C(C=C(C=C3)O)OC2=O)CC4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1C2=C(C3=C(C=C(C=C3)O)OC2=O)CC4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C30H31NO4/c1-21-7-3-4-8-25(21)29-27(26-14-11-23(32)20-28(26)35-30(29)33)19-22-9-12-24(13-10-22)34-18-17-31-15-5-2-6-16-31/h3-4,7-14,20,32H,2,5-6,15-19H2,1H3