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

Systemtic Name: 3-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-2-oxo-ethyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 3-[2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-2-oxoethyl]-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 3-[2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-2-keto-ethyl]-7-hydroxy-4-methyl-coumarin Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCN(CC3)CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCN(CC3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C24H31N3O5/c1-17-19-7-6-18(28)14-21(19)32-24(31)20(17)15-22(29)27-12-10-25(11-13-27)16-23(30)26-8-4-2-3-5-9-26/h6-7,14,28H,2-5,8-13,15-16H2,1H3