1-azanyl-4-(furan-2-ylmethylamino)-2-[2-hydroxyethyl(methyl)amino]anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(furan-2-ylmethylamino)-2-[2-hydroxyethyl(methyl)amino]anthracene-9,10-dione Openeye Name: 1-amino-4-(2-furylmethylamino)-2-[2-hydroxyethyl(methyl)amino]anthracene-9,10-dione CAS Name: 1-amino-4-(2-furanylmethylamino)-2-[2-hydroxyethyl(methyl)amino]anthracene-9,10-dione IUPAC Name: 1-amino-4-(furan-2-ylmethylamino)-2-[2-hydroxyethyl(methyl)amino]anthracene-9,10-dione Traditional Name: 1-amino-4-(2-furfurylamino)-2-[2-hydroxyethyl(methyl)amino]-9,10-anthraquinone Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C1=C(C2=C(C(=C1)NCC3=CC=CO3)C(=O)C4=CC=CC=C4C2=O)N

Isomeric SMILES

CN(CCO)C1=C(C2=C(C(=C1)NCC3=CC=CO3)C(=O)C4=CC=CC=C4C2=O)N

InChI

InChI=1S/C22H21N3O4/c1-25(8-9-26)17-11-16(24-12-13-5-4-10-29-13)18-19(20(17)23)22(28)15-7-3-2-6-14(15)21(18)27/h2-7,10-11,24,26H,8-9,12,23H2,1H3