methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-ethenyl-indazol-1-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-ethenyl-indazol-1-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-vinyl-indazol-1-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[6-[(cyclopentylmethylamino)-oxomethyl]-3-ethenyl-1-indazolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[6-(cyclopentylmethylcarbamoyl)-3-ethenylindazol-1-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[6-(cyclopentylmethylcarbamoyl)-3-vinyl-indazol-1-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CN2C3=C(C=CC(=C3)C(=O)NCC4CCCC4)C(=N2)C=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CN2C3=C(C=CC(=C3)C(=O)NCC4CCCC4)C(=N2)C=C

InChI

InChI=1S/C26H29N3O4/c1-4-22-21-12-11-18(25(30)27-15-17-7-5-6-8-17)13-23(21)29(28-22)16-20-10-9-19(26(31)33-3)14-24(20)32-2/h4,9-14,17H,1,5-8,15-16H2,2-3H3,(H,27,30)