4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,2-dione

Systemtic Name: 4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,2-dione Openeye Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,2-dione CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]naphthalene-1,2-dione IUPAC Name: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]naphthalene-1,2-dione Traditional Name: 4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-1,2-naphthoquinone Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC(=O)C(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC(=O)C(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H17N3O3/c1-13-19(21(27)24(23(13)2)14-8-4-3-5-9-14)22-17-12-18(25)20(26)16-11-7-6-10-15(16)17/h3-12,22H,1-2H3