methyl (2R)-2-[[5-(azepan-1-yl)-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[5-(azepan-1-yl)-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[5-(azepan-1-yl)-3,3-dimethyl-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[5-(1-azepanyl)-3,3-dimethyl-1,5-dioxopentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-(azepan-1-yl)-3,3-dimethyl-5-oxopentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[5-(azepan-1-yl)-5-keto-3,3-dimethyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C20H36N2O4 MolecularWeight: 368.51084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CC(C)(C)CC(=O)N1CCCCCC1

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)CC(C)(C)CC(=O)N1CCCCCC1

InChI

InChI=1S/C20H36N2O4/c1-15(2)12-16(19(25)26-5)21-17(23)13-20(3,4)14-18(24)22-10-8-6-7-9-11-22/h15-16H,6-14H2,1-5H3,(H,21,23)/t16-/m1/s1