1-azanyl-4-[(3-fluorophenyl)amino]-2-(4-methylpiperazin-1-yl)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-[(3-fluorophenyl)amino]-2-(4-methylpiperazin-1-yl)anthracene-9,10-dione Openeye Name: 1-amino-4-(3-fluoroanilino)-2-(4-methylpiperazin-1-yl)anthracene-9,10-dione CAS Name: 1-amino-4-(3-fluoroanilino)-2-(4-methyl-1-piperazinyl)anthracene-9,10-dione IUPAC Name: 1-amino-4-(3-fluoroanilino)-2-(4-methylpiperazin-1-yl)anthracene-9,10-dione Traditional Name: 1-amino-4-(3-fluoroanilino)-2-(4-methylpiperazino)-9,10-anthraquinone Formula: C25H23FN4O2 MolecularWeight: 430.474123

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C25H23FN4O2/c1-29-9-11-30(12-10-29)20-14-19(28-16-6-4-5-15(26)13-16)21-22(23(20)27)25(32)18-8-3-2-7-17(18)24(21)31/h2-8,13-14,28H,9-12,27H2,1H3