methyl 3-(3,3-diethoxypropyl)-1-(phenylmethyl)indazole-6-carboxylate

Systemtic Name: methyl 3-(3,3-diethoxypropyl)-1-(phenylmethyl)indazole-6-carboxylate Openeye Name: methyl 1-benzyl-3-(3,3-diethoxypropyl)indazole-6-carboxylate CAS Name: 3-(3,3-diethoxypropyl)-1-(phenylmethyl)-6-indazolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-3-(3,3-diethoxypropyl)indazole-6-carboxylate Traditional Name: 1-benzyl-3-(3,3-diethoxypropyl)indazole-6-carboxylic acid methyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCC1=NN(C2=C1C=CC(=C2)C(=O)OC)CC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC(CCC1=NN(C2=C1C=CC(=C2)C(=O)OC)CC3=CC=CC=C3)OCC

InChI

InChI=1S/C23H28N2O4/c1-4-28-22(29-5-2)14-13-20-19-12-11-18(23(26)27-3)15-21(19)25(24-20)16-17-9-7-6-8-10-17/h6-12,15,22H,4-5,13-14,16H2,1-3H3