3-[(Z)-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-1-(1-methoxy-1-oxidanylidene-propan-2-yl)indole-5-carboxylic acid

Systemtic Name: 3-[(Z)-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-1-(1-methoxy-1-oxidanylidene-propan-2-yl)indole-5-carboxylic acid Openeye Name: 3-[(Z)-(3-amino-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]-1-(2-methoxy-1-methyl-2-oxo-ethyl)indole-5-carboxylic acid CAS Name: 3-[(Z)-(3-amino-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-(1-methoxy-1-oxopropan-2-yl)-5-indolecarboxylic acid IUPAC Name: 3-[(Z)-(3-amino-5-oxo-1-phenylpyrazol-4-ylidene)methyl]-1-(1-methoxy-1-oxopropan-2-yl)indole-5-carboxylic acid Traditional Name: 3-[(Z)-(3-amino-5-keto-1-phenyl-2-pyrazolin-4-ylidene)methyl]-1-(2-keto-2-methoxy-1-methyl-ethyl)indole-5-carboxylic acid Formula: C23H20N4O5 MolecularWeight: 432.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C=C(C2=C1C=CC(=C2)C(=O)O)C=C3C(=NN(C3=O)C4=CC=CC=C4)N

Isomeric SMILES

CC(C(=O)OC)N1C=C(C2=C1C=CC(=C2)C(=O)O)/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)N

InChI

InChI=1S/C23H20N4O5/c1-13(23(31)32-2)26-12-15(17-10-14(22(29)30)8-9-19(17)26)11-18-20(24)25-27(21(18)28)16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,24,25)(H,29,30)/b18-11-