cyclohexanamine; (2S)-2-[2-(3,5-dimethoxyphenyl)propan-2-yloxycarbonylamino]-4-methyl-pentanoic acid

Systemtic Name: cyclohexanamine; (2S)-2-[2-(3,5-dimethoxyphenyl)propan-2-yloxycarbonylamino]-4-methyl-pentanoic acid Openeye Name: cyclohexanamine; (2S)-2-[[1-(3,5-dimethoxyphenyl)-1-methyl-ethoxy]carbonylamino]-4-methyl-pentanoic acid CAS Name: cyclohexanamine; (2S)-2-[[2-(3,5-dimethoxyphenyl)propan-2-yloxy-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: cyclohexanamine; (2S)-2-[2-(3,5-dimethoxyphenyl)propan-2-yloxycarbonylamino]-4-methylpentanoic acid Traditional Name: cyclohexylamine; (2S)-2-[[1-(3,5-dimethoxyphenyl)-1-methyl-ethoxy]carbonylamino]-4-methyl-valeric acid Formula: C24H40N2O6 MolecularWeight: 452.5842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)OC(C)(C)C1=CC(=CC(=C1)OC)OC.C1CCC(CC1)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C1=CC(=CC(=C1)OC)OC.C1CCC(CC1)N

InChI

InChI=1S/C18H27NO6.C6H13N/c1-11(2)7-15(16(20)21)19-17(22)25-18(3,4)12-8-13(23-5)10-14(9-12)24-6;7-6-4-2-1-3-5-6/h8-11,15H,7H2,1-6H3,(H,19,22)(H,20,21);6H,1-5,7H2/t15-;/m0./s1