2-[[1-aminocarbonyl-5-(cyclopentyloxycarbonylamino)indol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 2-[[1-aminocarbonyl-5-(cyclopentyloxycarbonylamino)indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 2-[[1-carbamoyl-5-(cyclopentoxycarbonylamino)indol-3-yl]methyl]-3-methoxy-benzoic acid CAS Name: 2-[[1-carbamoyl-5-[[cyclopentyloxy(oxo)methyl]amino]-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 2-[[1-carbamoyl-5-(cyclopentyloxycarbonylamino)indol-3-yl]methyl]-3-methoxybenzoic acid Traditional Name: 2-[[1-carbamoyl-5-(cyclopentoxycarbonylamino)indol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C24H25N3O6 MolecularWeight: 451.4718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CC2=CN(C3=C2C=C(C=C3)NC(=O)OC4CCCC4)C(=O)N)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1CC2=CN(C3=C2C=C(C=C3)NC(=O)OC4CCCC4)C(=O)N)C(=O)O

InChI

InChI=1S/C24H25N3O6/c1-32-21-8-4-7-17(22(28)29)19(21)11-14-13-27(23(25)30)20-10-9-15(12-18(14)20)26-24(31)33-16-5-2-3-6-16/h4,7-10,12-13,16H,2-3,5-6,11H2,1H3,(H2,25,30)(H,26,31)(H,28,29)