[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] (2R)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] (2R)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl] (2R)-2-(4-cyanophenoxy)propanoate CAS Name: (2R)-2-(4-cyanophenoxy)propanoic acid [2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl] (2R)-2-(4-cyanophenoxy)propanoate Traditional Name: (2R)-2-(4-cyanophenoxy)propionic acid [2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl] ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N(C)CC1=CC=C(C=C1)N(C)C)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H](C(=O)OCC(=O)N(C)CC1=CC=C(C=C1)N(C)C)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H25N3O4/c1-16(29-20-11-7-17(13-23)8-12-20)22(27)28-15-21(26)25(4)14-18-5-9-19(10-6-18)24(2)3/h5-12,16H,14-15H2,1-4H3/t16-/m1/s1