methyl 4-[1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]indazol-3-yl]benzoate

Systemtic Name: methyl 4-[1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]indazol-3-yl]benzoate Openeye Name: methyl 4-[1-[(1-isopentylbenzimidazol-2-yl)methyl]indazol-3-yl]benzoate CAS Name: 4-[1-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-3-indazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]indazol-3-yl]benzoate Traditional Name: 4-[1-[(1-isoamylbenzimidazol-2-yl)methyl]indazol-3-yl]benzoic acid methyl ester Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4C(=N3)C5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C28H28N4O2/c1-19(2)16-17-31-25-11-7-5-9-23(25)29-26(31)18-32-24-10-6-4-8-22(24)27(30-32)20-12-14-21(15-13-20)28(33)34-3/h4-15,19H,16-18H2,1-3H3