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

Systemtic Name: 1-azanyl-2-(azepan-1-yl)-4-(2-methoxyethylamino)anthracene-9,10-dione Openeye Name: 1-amino-2-(azepan-1-yl)-4-(2-methoxyethylamino)anthracene-9,10-dione CAS Name: 1-amino-2-(1-azepanyl)-4-(2-methoxyethylamino)anthracene-9,10-dione IUPAC Name: 1-amino-2-(azepan-1-yl)-4-(2-methoxyethylamino)anthracene-9,10-dione Traditional Name: 1-amino-2-(azepan-1-yl)-4-(2-methoxyethylamino)-9,10-anthraquinone Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C2C(=C(C(=C1)N3CCCCCC3)N)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

COCCNC1=C2C(=C(C(=C1)N3CCCCCC3)N)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C23H27N3O3/c1-29-13-10-25-17-14-18(26-11-6-2-3-7-12-26)21(24)20-19(17)22(27)15-8-4-5-9-16(15)23(20)28/h4-5,8-9,14,25H,2-3,6-7,10-13,24H2,1H3