1-(3-methoxy-4-oxidanyl-phenyl)propane-1,2,3-triol; 3-methylbutyl 2-(2-diethylaminoethylamino)-2-phenyl-ethanoate

Systemtic Name: 1-(3-methoxy-4-oxidanyl-phenyl)propane-1,2,3-triol; 3-methylbutyl 2-(2-diethylaminoethylamino)-2-phenyl-ethanoate Openeye Name: 1-(4-hydroxy-3-methoxy-phenyl)propane-1,2,3-triol; isopentyl 2-(2-diethylaminoethylamino)-2-phenyl-acetate CAS Name: 2-(2-diethylaminoethylamino)-2-phenylacetic acid 3-methylbutyl ester; 1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol; 3-methylbutyl 2-(2-diethylaminoethylamino)-2-phenylacetate Traditional Name: 2-(2-diethylaminoethylamino)-2-phenyl-acetic acid isoamyl ester; 1-(4-hydroxy-3-methoxy-phenyl)propane-1,2,3-triol Formula: C29H46N2O7 MolecularWeight: 534.68474

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(C1=CC=CC=C1)C(=O)OCCC(C)C.COC1=C(C=CC(=C1)C(C(CO)O)O)O

Isomeric SMILES

CCN(CC)CCNC(C1=CC=CC=C1)C(=O)OCCC(C)C.COC1=C(C=CC(=C1)C(C(CO)O)O)O

InChI

InChI=1S/C19H32N2O2.C10H14O5/c1-5-21(6-2)14-13-20-18(17-10-8-7-9-11-17)19(22)23-15-12-16(3)4;1-15-9-4-6(2-3-7(9)12)10(14)8(13)5-11/h7-11,16,18,20H,5-6,12-15H2,1-4H3;2-4,8,10-14H,5H2,1H3