[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate Openeye Name: [2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl] (2S)-2-phenoxybutanoate CAS Name: (2S)-2-phenoxybutanoic acid [2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl] (2S)-2-phenoxybutanoate Traditional Name: (2S)-2-phenoxybutyric acid [2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl] ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4/c1-5-20(28-19-9-7-6-8-10-19)22(26)27-16-21(25)24(4)15-17-11-13-18(14-12-17)23(2)3/h6-14,20H,5,15-16H2,1-4H3/t20-/m0/s1