1-azanyl-4-(butan-2-ylamino)-8-nitro-5-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(butan-2-ylamino)-8-nitro-5-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-5-hydroxy-8-nitro-4-(sec-butylamino)anthracene-9,10-dione CAS Name: 1-amino-4-(butan-2-ylamino)-5-hydroxy-8-nitroanthracene-9,10-dione IUPAC Name: 1-amino-4-(butan-2-ylamino)-5-hydroxy-8-nitroanthracene-9,10-dione Traditional Name: 1-amino-5-hydroxy-8-nitro-4-(sec-butylamino)-9,10-anthraquinone Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C2C(=C(C=C1)N)C(=O)C3=C(C=CC(=C3C2=O)O)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C2C(=C(C=C1)N)C(=O)C3=C(C=CC(=C3C2=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5/c1-3-8(2)20-10-5-4-9(19)13-14(10)18(24)16-12(22)7-6-11(21(25)26)15(16)17(13)23/h4-8,20,22H,3,19H2,1-2H3