(2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butyramide Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C(C(C)C)NC(=O)COC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)[C@H](C(C)C)NC(=O)COC2=CC=CC=C2)OCC

InChI

InChI=1S/C25H34N2O5/c1-5-30-21-13-12-19(16-22(21)31-6-2)14-15-26-25(29)24(18(3)4)27-23(28)17-32-20-10-8-7-9-11-20/h7-13,16,18,24H,5-6,14-15,17H2,1-4H3,(H,26,29)(H,27,28)/t24-/m0/s1