methyl 2-(hexylcarbamoyl)-3-oxidanylidene-1H-indazole-4-carboxylate

Systemtic Name: methyl 2-(hexylcarbamoyl)-3-oxidanylidene-1H-indazole-4-carboxylate Openeye Name: methyl 2-(hexylcarbamoyl)-3-oxo-1H-indazole-4-carboxylate CAS Name: 2-[(hexylamino)-oxomethyl]-3-oxo-1H-indazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-(hexylcarbamoyl)-3-oxo-1H-indazole-4-carboxylate Traditional Name: 2-(hexylcarbamoyl)-3-keto-indazoline-4-carboxylic acid methyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N1C(=O)C2=C(C=CC=C2N1)C(=O)OC

Isomeric SMILES

CCCCCCNC(=O)N1C(=O)C2=C(C=CC=C2N1)C(=O)OC

InChI

InChI=1S/C16H21N3O4/c1-3-4-5-6-10-17-16(22)19-14(20)13-11(15(21)23-2)8-7-9-12(13)18-19/h7-9,18H,3-6,10H2,1-2H3,(H,17,22)