methyl 2-[[3-(1-azanylethenyl)phenyl]methyl]-3-(3-phenylprop-2-ynoylamino)butanoate

Systemtic Name: methyl 2-[[3-(1-azanylethenyl)phenyl]methyl]-3-(3-phenylprop-2-ynoylamino)butanoate Openeye Name: methyl 2-[[3-(1-aminovinyl)phenyl]methyl]-3-(3-phenylprop-2-ynoylamino)butanoate CAS Name: 2-[[3-(1-aminoethenyl)phenyl]methyl]-3-[(1-oxo-3-phenylprop-2-ynyl)amino]butanoic acid methyl ester IUPAC Name: methyl 2-[[3-(1-aminoethenyl)phenyl]methyl]-3-(3-phenylprop-2-ynoylamino)butanoate Traditional Name: 2-[3-(1-aminovinyl)benzyl]-3-[(3-phenylpropioloyl)amino]butyric acid methyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC(=C1)C(=C)N)C(=O)OC)NC(=O)C#CC2=CC=CC=C2

Isomeric SMILES

CC(C(CC1=CC=CC(=C1)C(=C)N)C(=O)OC)NC(=O)C#CC2=CC=CC=C2

InChI

InChI=1S/C23H24N2O3/c1-16(24)20-11-7-10-19(14-20)15-21(23(27)28-3)17(2)25-22(26)13-12-18-8-5-4-6-9-18/h4-11,14,17,21H,1,15,24H2,2-3H3,(H,25,26)