[(4R)-1-oxidanylidene-1-[(phenylmethyl)amino]octan-4-yl] 3,5-dimethoxybenzoate

Systemtic Name: [(4R)-1-oxidanylidene-1-[(phenylmethyl)amino]octan-4-yl] 3,5-dimethoxybenzoate Openeye Name: [(1R)-1-[3-(benzylamino)-3-oxo-propyl]pentyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [(4R)-1-oxo-1-[(phenylmethyl)amino]octan-4-yl] ester IUPAC Name: [(4R)-1-(benzylamino)-1-oxooctan-4-yl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [(1R)-1-[3-(benzylamino)-3-keto-propyl]pentyl] ester Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CCCC[C@H](CCC(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C24H31NO5/c1-4-5-11-20(12-13-23(26)25-17-18-9-7-6-8-10-18)30-24(27)19-14-21(28-2)16-22(15-19)29-3/h6-10,14-16,20H,4-5,11-13,17H2,1-3H3,(H,25,26)/t20-/m1/s1