methyl (2S,3S)-2-[[4-(1-ethanoylpiperidin-4-yl)oxy-3-methoxy-phenyl]carbonylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2S,3S)-2-[[4-(1-ethanoylpiperidin-4-yl)oxy-3-methoxy-phenyl]carbonylamino]-3-methyl-pentanoate Openeye Name: methyl (2S,3S)-2-[[4-[(1-acetyl-4-piperidyl)oxy]-3-methoxy-benzoyl]amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[[4-[(1-acetyl-4-piperidinyl)oxy]-3-methoxyphenyl]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[[4-(1-acetylpiperidin-4-yl)oxy-3-methoxybenzoyl]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[[4-[(1-acetyl-4-piperidyl)oxy]-3-methoxy-benzoyl]amino]-3-methyl-valeric acid methyl ester Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C)OC

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C)OC

InChI

InChI=1S/C22H32N2O6/c1-6-14(2)20(22(27)29-5)23-21(26)16-7-8-18(19(13-16)28-4)30-17-9-11-24(12-10-17)15(3)25/h7-8,13-14,17,20H,6,9-12H2,1-5H3,(H,23,26)/t14-,20-/m0/s1