1-[[3-(diethylamino)-2-oxidanyl-propyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione

Systemtic Name: 1-[[3-(diethylamino)-2-oxidanyl-propyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione Openeye Name: 1-[[3-(diethylamino)-2-hydroxy-propyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione CAS Name: 1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4-(2-oxiranylmethylamino)anthracene-9,10-dione IUPAC Name: 1-[[3-(diethylamino)-2-hydroxypropyl]amino]-4-(oxiran-2-ylmethylamino)anthracene-9,10-dione Traditional Name: 1-[[3-(diethylamino)-2-hydroxy-propyl]amino]-4-(glycidylamino)-9,10-anthraquinone Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC1=C2C(=C(C=C1)NCC3CO3)C(=O)C4=CC=CC=C4C2=O)O

Isomeric SMILES

CCN(CC)CC(CNC1=C2C(=C(C=C1)NCC3CO3)C(=O)C4=CC=CC=C4C2=O)O

InChI

InChI=1S/C24H29N3O4/c1-3-27(4-2)13-15(28)11-25-19-9-10-20(26-12-16-14-31-16)22-21(19)23(29)17-7-5-6-8-18(17)24(22)30/h5-10,15-16,25-26,28H,3-4,11-14H2,1-2H3