3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 3-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-7-hydroxy-4-methyl-coumarin Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N2O4/c1-20-24-13-12-23(32)18-26(24)35-29(34)25(20)19-27(33)30-14-16-31(17-15-30)28(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,28,32H,14-17,19H2,1H3