2,3-bis[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butyl]-5-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2,3-bis[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butyl]-5-oxidanyl-naphthalene-1,4-dione Openeye Name: 5-hydroxy-2,3-bis[4-(4-methylpiperazin-1-yl)-4-oxo-butyl]naphthalene-1,4-dione CAS Name: 5-hydroxy-2,3-bis[4-(4-methyl-1-piperazinyl)-4-oxobutyl]naphthalene-1,4-dione IUPAC Name: 5-hydroxy-2,3-bis[4-(4-methylpiperazin-1-yl)-4-oxobutyl]naphthalene-1,4-dione Traditional Name: 5-hydroxy-2,3-bis[4-keto-4-(4-methylpiperazino)butyl]-1,4-naphthoquinone Formula: C28H38N4O5 MolecularWeight: 510.62512

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCC2=C(C(=O)C3=C(C2=O)C=CC=C3O)CCCC(=O)N4CCN(CC4)C

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCC2=C(C(=O)C3=C(C2=O)C=CC=C3O)CCCC(=O)N4CCN(CC4)C

InChI

InChI=1S/C28H38N4O5/c1-29-12-16-31(17-13-29)24(34)10-4-6-20-21(7-5-11-25(35)32-18-14-30(2)15-19-32)28(37)26-22(27(20)36)8-3-9-23(26)33/h3,8-9,33H,4-7,10-19H2,1-2H3