(3S)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-1-keto-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-phenyl-isochroman-6-carboxamide Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)C(=O)O[C@@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O4/c1-17-24(26(32)30(29(17)2)21-11-7-4-8-12-21)28-25(31)19-13-14-22-20(15-19)16-23(34-27(22)33)18-9-5-3-6-10-18/h3-15,23H,16H2,1-2H3,(H,28,31)/t23-/m0/s1