methyl 6-methyl-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3-propan-2-yl-benzoate

Systemtic Name: methyl 6-methyl-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3-propan-2-yl-benzoate Openeye Name: methyl 2-[2-hydroxy-3-(isopropylamino)propoxy]-3-isopropyl-6-methyl-benzoate CAS Name: 2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-6-methyl-3-propan-2-ylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-hydroxy-3-(propan-2-ylamino)propoxy]-6-methyl-3-propan-2-ylbenzoate Traditional Name: 2-[2-hydroxy-3-(isopropylamino)propoxy]-3-isopropyl-6-methyl-benzoic acid methyl ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)OCC(CNC(C)C)O)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)OCC(CNC(C)C)O)C(=O)OC

InChI

InChI=1S/C18H29NO4/c1-11(2)15-8-7-13(5)16(18(21)22-6)17(15)23-10-14(20)9-19-12(3)4/h7-8,11-12,14,19-20H,9-10H2,1-6H3