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

Systemtic Name: 3-[3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[3-(4-benzhydrylpiperazin-1-yl)-3-oxo-propyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 3-[3-[4-(diphenylmethyl)-1-piperazinyl]-3-oxopropyl]-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-(4-benzhydrylpiperazin-1-yl)-3-oxopropyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-[3-(4-benzhydrylpiperazino)-3-keto-propyl]-7-hydroxy-4-methyl-coumarin Formula: C30H30N2O4 MolecularWeight: 482.5702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30N2O4/c1-21-25-13-12-24(33)20-27(25)36-30(35)26(21)14-15-28(34)31-16-18-32(19-17-31)29(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,20,29,33H,14-19H2,1H3