N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-oxidanylidene-pyran-3-carboxamide

Systemtic Name: N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-oxidanylidene-pyran-3-carboxamide Openeye Name: N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-oxo-pyran-3-carboxamide CAS Name: N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-oxo-3-pyrancarboxamide IUPAC Name: N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-oxopyran-3-carboxamide Traditional Name: N-[(4R)-1-(2,3-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-6-keto-pyran-3-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C3=C(C=N2)C(CCC3)NC(=O)C4=COC(=O)C=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C3=C(C=N2)[C@@H](CCC3)NC(=O)C4=COC(=O)C=C4)C

InChI

InChI=1S/C21H21N3O3/c1-13-5-3-7-18(14(13)2)24-19-8-4-6-17(16(19)11-22-24)23-21(26)15-9-10-20(25)27-12-15/h3,5,7,9-12,17H,4,6,8H2,1-2H3,(H,23,26)/t17-/m1/s1