methyl 4-(2-cyclopentylethanoylamino)-2-(2,3-dihydroindazol-1-ylmethyl)-3-methoxy-6-oxidanylidene-3-propyl-cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: methyl 4-(2-cyclopentylethanoylamino)-2-(2,3-dihydroindazol-1-ylmethyl)-3-methoxy-6-oxidanylidene-3-propyl-cyclohexa-1,4-diene-1-carboxylate Openeye Name: methyl 4-[(2-cyclopentylacetyl)amino]-2-(2,3-dihydroindazol-1-ylmethyl)-3-methoxy-6-oxo-3-propyl-cyclohexa-1,4-diene-1-carboxylate CAS Name: 4-[(2-cyclopentyl-1-oxoethyl)amino]-2-(2,3-dihydroindazol-1-ylmethyl)-3-methoxy-6-oxo-3-propyl-1-cyclohexa-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-cyclopentylacetyl)amino]-2-(2,3-dihydroindazol-1-ylmethyl)-3-methoxy-6-oxo-3-propylcyclohexa-1,4-diene-1-carboxylate Traditional Name: 4-[(2-cyclopentylacetyl)amino]-2-(indazolin-1-ylmethyl)-6-keto-3-methoxy-3-propyl-cyclohexa-1,4-diene-1-carboxylic acid methyl ester Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=CC(=O)C(=C1CN2C3=CC=CC=C3CN2)C(=O)OC)NC(=O)CC4CCCC4)OC

Isomeric SMILES

CCCC1(C(=CC(=O)C(=C1CN2C3=CC=CC=C3CN2)C(=O)OC)NC(=O)CC4CCCC4)OC

InChI

InChI=1S/C27H35N3O5/c1-4-13-27(35-3)20(17-30-21-12-8-7-11-19(21)16-28-30)25(26(33)34-2)22(31)15-23(27)29-24(32)14-18-9-5-6-10-18/h7-8,11-12,15,18,28H,4-6,9-10,13-14,16-17H2,1-3H3,(H,29,32)