4-[[1-(2-azanyl-2-oxidanylidene-ethyl)-5-(cyclopentylmethylcarbamoyl)indazol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)-5-(cyclopentylmethylcarbamoyl)indazol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[1-(2-amino-2-oxo-ethyl)-5-(cyclopentylmethylcarbamoyl)indazol-3-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[1-(2-amino-2-oxoethyl)-5-[(cyclopentylmethylamino)-oxomethyl]-3-indazolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[1-(2-amino-2-oxoethyl)-5-(cyclopentylmethylcarbamoyl)indazol-3-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[1-(2-amino-2-keto-ethyl)-5-(cyclopentylmethylcarbamoyl)indazol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CC2=NN(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)CC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CC2=NN(C3=C2C=C(C=C3)C(=O)NCC4CCCC4)CC(=O)N

InChI

InChI=1S/C25H28N4O5/c1-34-22-12-18(25(32)33)7-6-16(22)11-20-19-10-17(24(31)27-13-15-4-2-3-5-15)8-9-21(19)29(28-20)14-23(26)30/h6-10,12,15H,2-5,11,13-14H2,1H3,(H2,26,30)(H,27,31)(H,32,33)