N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-[2-(2,4-dichlorobenzyl)pyrazol-3-yl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C21H17Cl2N3O3 MolecularWeight: 430.28398

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=NN3CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H17Cl2N3O3/c1-21(11-13-4-2-3-5-16(13)19(27)29-21)20(28)25-18-8-9-24-26(18)12-14-6-7-15(22)10-17(14)23/h2-10H,11-12H2,1H3,(H,25,28)