methyl (2R)-2-[[1-[(5-methoxy-2-oxidanyl-phenyl)methyl]piperidin-4-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[1-[(5-methoxy-2-oxidanyl-phenyl)methyl]piperidin-4-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[1-[(2-hydroxy-5-methoxy-phenyl)methyl]piperidine-4-carbonyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[[1-[(2-hydroxy-5-methoxyphenyl)methyl]-4-piperidinyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidine-4-carbonyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[1-(2-hydroxy-5-methoxy-benzyl)isonipecotoyl]amino]-4-methyl-valeric acid methyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1CCN(CC1)CC2=C(C=CC(=C2)OC)O

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)C1CCN(CC1)CC2=C(C=CC(=C2)OC)O

InChI

InChI=1S/C21H32N2O5/c1-14(2)11-18(21(26)28-4)22-20(25)15-7-9-23(10-8-15)13-16-12-17(27-3)5-6-19(16)24/h5-6,12,14-15,18,24H,7-11,13H2,1-4H3,(H,22,25)/t18-/m1/s1