1-azanyl-2-(4,4-dimethyl-3-oxidanylidene-pent-1-ynyl)anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-(4,4-dimethyl-3-oxidanylidene-pent-1-ynyl)anthracene-9,10-dione Openeye Name: 1-amino-2-(4,4-dimethyl-3-oxo-pent-1-ynyl)anthracene-9,10-dione CAS Name: 1-amino-2-(4,4-dimethyl-3-oxopent-1-ynyl)anthracene-9,10-dione IUPAC Name: 1-amino-2-(4,4-dimethyl-3-oxopent-1-ynyl)anthracene-9,10-dione Traditional Name: 1-amino-2-(3-keto-4,4-dimethyl-pent-1-ynyl)-9,10-anthraquinone Formula: C21H17NO3 MolecularWeight: 331.36458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C#CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N

Isomeric SMILES

CC(C)(C)C(=O)C#CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N

InChI

InChI=1S/C21H17NO3/c1-21(2,3)16(23)11-9-12-8-10-15-17(18(12)22)20(25)14-7-5-4-6-13(14)19(15)24/h4-8,10H,22H2,1-3H3