1-azanyl-2-(azepan-1-yl)-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-(azepan-1-yl)-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-2-(azepan-1-yl)-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-2-(1-azepanyl)-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-2-(azepan-1-yl)-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-2-(azepan-1-yl)-4-hydroxy-9,10-anthraquinone Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

C1CCCN(CC1)C2=CC(=C3C(=C2N)C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C20H20N2O3/c21-18-14(22-9-5-1-2-6-10-22)11-15(23)16-17(18)20(25)13-8-4-3-7-12(13)19(16)24/h3-4,7-8,11,23H,1-2,5-6,9-10,21H2