(diphenylmethyl) 1-(3-chloranylpropyl)-2-[(2-methyl-6-propan-2-yl-phenyl)methylcarbamoyl]-3-oxidanylidene-indazole-7-carboxylate

Systemtic Name: (diphenylmethyl) 1-(3-chloranylpropyl)-2-[(2-methyl-6-propan-2-yl-phenyl)methylcarbamoyl]-3-oxidanylidene-indazole-7-carboxylate Openeye Name: benzhydryl 1-(3-chloropropyl)-2-[(2-isopropyl-6-methyl-phenyl)methylcarbamoyl]-3-oxo-indazole-7-carboxylate CAS Name: 1-(3-chloropropyl)-2-[[(2-methyl-6-propan-2-ylphenyl)methylamino]-oxomethyl]-3-oxo-7-indazolecarboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 1-(3-chloropropyl)-2-[(2-methyl-6-propan-2-ylphenyl)methylcarbamoyl]-3-oxoindazole-7-carboxylate Traditional Name: 1-(3-chloropropyl)-2-[(2-isopropyl-6-methyl-benzyl)carbamoyl]-3-keto-indazoline-7-carboxylic acid benzhydryl ester Formula: C36H36ClN3O4 MolecularWeight: 610.14174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)CNC(=O)N2C(=O)C3=C(N2CCCCl)C(=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)CNC(=O)N2C(=O)C3=C(N2CCCCl)C(=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H36ClN3O4/c1-24(2)28-18-10-13-25(3)31(28)23-38-36(43)40-34(41)29-19-11-20-30(32(29)39(40)22-12-21-37)35(42)44-33(26-14-6-4-7-15-26)27-16-8-5-9-17-27/h4-11,13-20,24,33H,12,21-23H2,1-3H3,(H,38,43)