2-[[1-(2-azanyl-2-oxidanylidene-ethyl)indazol-3-yl]methyl]-5-(cyclopentylmethylcarbamoyl)-3-methoxy-benzoic acid

Systemtic Name: 2-[[1-(2-azanyl-2-oxidanylidene-ethyl)indazol-3-yl]methyl]-5-(cyclopentylmethylcarbamoyl)-3-methoxy-benzoic acid Openeye Name: 2-[[1-(2-amino-2-oxo-ethyl)indazol-3-yl]methyl]-5-(cyclopentylmethylcarbamoyl)-3-methoxy-benzoic acid CAS Name: 2-[[1-(2-amino-2-oxoethyl)-3-indazolyl]methyl]-5-[(cyclopentylmethylamino)-oxomethyl]-3-methoxybenzoic acid IUPAC Name: 2-[[1-(2-amino-2-oxoethyl)indazol-3-yl]methyl]-5-(cyclopentylmethylcarbamoyl)-3-methoxybenzoic acid Traditional Name: 2-[[1-(2-amino-2-keto-ethyl)indazol-3-yl]methyl]-5-(cyclopentylmethylcarbamoyl)-3-methoxy-benzoic acid Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1CC2=NN(C3=CC=CC=C32)CC(=O)N)C(=O)O)C(=O)NCC4CCCC4

Isomeric SMILES

COC1=CC(=CC(=C1CC2=NN(C3=CC=CC=C32)CC(=O)N)C(=O)O)C(=O)NCC4CCCC4

InChI

InChI=1S/C25H28N4O5/c1-34-22-11-16(24(31)27-13-15-6-2-3-7-15)10-19(25(32)33)18(22)12-20-17-8-4-5-9-21(17)29(28-20)14-23(26)30/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3,(H2,26,30)(H,27,31)(H,32,33)