(2R)-3-methyl-2-[[3-oxidanylidene-3-(4-propoxyphenyl)propyl]amino]pentanoic acid

Systemtic Name: (2R)-3-methyl-2-[[3-oxidanylidene-3-(4-propoxyphenyl)propyl]amino]pentanoic acid Openeye Name: (2R)-3-methyl-2-[[3-oxo-3-(4-propoxyphenyl)propyl]amino]pentanoic acid CAS Name: (2R)-3-methyl-2-[[3-oxo-3-(4-propoxyphenyl)propyl]amino]pentanoic acid IUPAC Name: (2R)-3-methyl-2-[[3-oxo-3-(4-propoxyphenyl)propyl]amino]pentanoic acid Traditional Name: (2R)-2-[[3-keto-3-(4-propoxyphenyl)propyl]amino]-3-methyl-valeric acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCNC(C(C)CC)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCN[C@H](C(C)CC)C(=O)O

InChI

InChI=1S/C18H27NO4/c1-4-12-23-15-8-6-14(7-9-15)16(20)10-11-19-17(18(21)22)13(3)5-2/h6-9,13,17,19H,4-5,10-12H2,1-3H3,(H,21,22)/t13?,17-/m1/s1