1-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(phenethylamino)anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(phenethylamino)anthracene-9,10-dione Openeye Name: 1-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(phenethylamino)anthracene-9,10-dione CAS Name: 1-amino-2-[4-(2-hydroxyethyl)-1-piperazinyl]-4-(phenethylamino)anthracene-9,10-dione IUPAC Name: 1-amino-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(phenethylamino)anthracene-9,10-dione Traditional Name: 1-amino-2-[4-(2-hydroxyethyl)piperazino]-4-(phenethylamino)-9,10-anthraquinone Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCO)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O3/c29-26-23(32-14-12-31(13-15-32)16-17-33)18-22(30-11-10-19-6-2-1-3-7-19)24-25(26)28(35)21-9-5-4-8-20(21)27(24)34/h1-9,18,30,33H,10-17,29H2