1-[(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)methyl]anthracene-9,10-dione

Systemtic Name: 1-[(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)methyl]anthracene-9,10-dione Openeye Name: 1-[(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)methyl]anthracene-9,10-dione CAS Name: 1-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)methyl]anthracene-9,10-dione IUPAC Name: 1-[(4-amino-5-hydroxy-6-methyloxan-2-yl)methyl]anthracene-9,10-dione Traditional Name: 1-[(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)methyl]-9,10-anthraquinone Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)CC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)N)O

Isomeric SMILES

CC1C(C(CC(O1)CC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)N)O

InChI

InChI=1S/C21H21NO4/c1-11-19(23)17(22)10-13(26-11)9-12-5-4-8-16-18(12)21(25)15-7-3-2-6-14(15)20(16)24/h2-8,11,13,17,19,23H,9-10,22H2,1H3