1-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)-3-(3-oxidanylpropylamino)propan-2-ol; ethanedioic acid

Systemtic Name: 1-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)-3-(3-oxidanylpropylamino)propan-2-ol; ethanedioic acid Openeye Name: 1-(4-chloro-2-isopropyl-5-methyl-phenoxy)-3-(3-hydroxypropylamino)propan-2-ol; oxalic acid CAS Name: 1-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-3-(3-hydroxypropylamino)-2-propanol; oxalic acid IUPAC Name: 1-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-3-(3-hydroxypropylamino)propan-2-ol; oxalic acid Traditional Name: 1-(4-chloro-2-isopropyl-5-methyl-phenoxy)-3-(3-hydroxypropylamino)propan-2-ol; oxalic acid Formula: C18H28ClNO7 MolecularWeight: 405.87042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCC(CNCCCO)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCC(CNCCCO)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H26ClNO3.C2H2O4/c1-11(2)14-8-15(17)12(3)7-16(14)21-10-13(20)9-18-5-4-6-19;3-1(4)2(5)6/h7-8,11,13,18-20H,4-6,9-10H2,1-3H3;(H,3,4)(H,5,6)