2-[[methoxy(phenyl)methyl]-(3-methylbutyl)carbamoyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[[methoxy(phenyl)methyl]-(3-methylbutyl)carbamoyl]oxirane-2-carboxylic acid Openeye Name: 2-[isopentyl-[methoxy(phenyl)methyl]carbamoyl]oxirane-2-carboxylic acid CAS Name: 2-[[[methoxy(phenyl)methyl]-(3-methylbutyl)amino]-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[[methoxy(phenyl)methyl]-(3-methylbutyl)carbamoyl]oxirane-2-carboxylic acid Traditional Name: 2-[isoamyl-[methoxy(phenyl)methyl]carbamoyl]oxirane-2-carboxylic acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(C1=CC=CC=C1)OC)C(=O)C2(CO2)C(=O)O

Isomeric SMILES

CC(C)CCN(C(C1=CC=CC=C1)OC)C(=O)C2(CO2)C(=O)O

InChI

InChI=1S/C17H23NO5/c1-12(2)9-10-18(15(19)17(11-23-17)16(20)21)14(22-3)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H,20,21)