[(2S)-2-(dimethylamino)-3-phenyl-propyl] 4-azanyl-2-butoxy-benzoate

Systemtic Name: [(2S)-2-(dimethylamino)-3-phenyl-propyl] 4-azanyl-2-butoxy-benzoate Openeye Name: [(2S)-2-(dimethylamino)-3-phenyl-propyl] 4-amino-2-butoxy-benzoate CAS Name: 4-amino-2-butoxybenzoic acid [(2S)-2-(dimethylamino)-3-phenylpropyl] ester IUPAC Name: [(2S)-2-(dimethylamino)-3-phenylpropyl] 4-amino-2-butoxybenzoate Traditional Name: 4-amino-2-butoxy-benzoic acid [(2S)-2-(dimethylamino)-3-phenyl-propyl] ester Formula: C22H30N2O3 MolecularWeight: 370.4852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)N)C(=O)OCC(CC2=CC=CC=C2)N(C)C

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)N)C(=O)OC[C@H](CC2=CC=CC=C2)N(C)C

InChI

InChI=1S/C22H30N2O3/c1-4-5-13-26-21-15-18(23)11-12-20(21)22(25)27-16-19(24(2)3)14-17-9-7-6-8-10-17/h6-12,15,19H,4-5,13-14,16,23H2,1-3H3/t19-/m0/s1