2-diethylaminoethyl 3-oxidanyl-2-phenyl-octanoate

Systemtic Name: 2-diethylaminoethyl 3-oxidanyl-2-phenyl-octanoate Openeye Name: 2-diethylaminoethyl 3-hydroxy-2-phenyl-octanoate CAS Name: 3-hydroxy-2-phenyloctanoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-hydroxy-2-phenyloctanoate Traditional Name: 3-hydroxy-2-phenyl-caprylic acid 2-diethylaminoethyl ester Formula: C20H33NO3 MolecularWeight: 335.48092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C1=CC=CC=C1)C(=O)OCCN(CC)CC)O

Isomeric SMILES

CCCCCC(C(C1=CC=CC=C1)C(=O)OCCN(CC)CC)O

InChI

InChI=1S/C20H33NO3/c1-4-7-9-14-18(22)19(17-12-10-8-11-13-17)20(23)24-16-15-21(5-2)6-3/h8,10-13,18-19,22H,4-7,9,14-16H2,1-3H3