2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[[cyclopropyl-[(4-isopropylphenyl)methyl]amino]methyl]oxazole-4-carboxylic acid CAS Name: 2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[[cyclopropyl-(4-isopropylbenzyl)amino]methyl]oxazole-4-carboxylic acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(CC2=NC(=CO2)C(=O)O)C3CC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(CC2=NC(=CO2)C(=O)O)C3CC3

InChI

InChI=1S/C18H22N2O3/c1-12(2)14-5-3-13(4-6-14)9-20(15-7-8-15)10-17-19-16(11-23-17)18(21)22/h3-6,11-12,15H,7-10H2,1-2H3,(H,21,22)