methyl 2-[[3-[3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]indol-1-yl]-2-oxidanyl-propyl]amino]ethanoate

Systemtic Name: methyl 2-[[3-[3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]indol-1-yl]-2-oxidanyl-propyl]amino]ethanoate Openeye Name: methyl 2-[[2-hydroxy-3-[3-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]indol-1-yl]propyl]amino]acetate CAS Name: 2-[[2-hydroxy-3-[3-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-indolyl]propyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-hydroxy-3-[3-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]indol-1-yl]propyl]amino]acetate Traditional Name: 2-[[2-hydroxy-3-[3-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]indol-1-yl]propyl]amino]acetic acid methyl ester Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNCC(=O)OC)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNCC(=O)OC)O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O4/c1-17-22(25(32)29(27-17)19-8-4-3-5-9-19)12-18-15-28(23-11-7-6-10-21(18)23)16-20(30)13-26-14-24(31)33-2/h3-12,15,20,26,30H,13-14,16H2,1-2H3