methyl 4-azanyl-2-[2,2-diphenylethanoyl(3-imidazol-1-ylpropyl)amino]butanoate

Systemtic Name: methyl 4-azanyl-2-[2,2-diphenylethanoyl(3-imidazol-1-ylpropyl)amino]butanoate Openeye Name: methyl 4-amino-2-[(2,2-diphenylacetyl)-(3-imidazol-1-ylpropyl)amino]butanoate CAS Name: 4-amino-2-[3-(1-imidazolyl)propyl-(1-oxo-2,2-diphenylethyl)amino]butanoic acid methyl ester IUPAC Name: methyl 4-amino-2-[(2,2-diphenylacetyl)-(3-imidazol-1-ylpropyl)amino]butanoate Traditional Name: 4-amino-2-[(2,2-diphenylacetyl)-(3-imidazol-1-ylpropyl)amino]butyric acid methyl ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCN)N(CCCN1C=CN=C1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CCN)N(CCCN1C=CN=C1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H30N4O3/c1-32-25(31)22(13-14-26)29(17-8-16-28-18-15-27-19-28)24(30)23(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-7,9-12,15,18-19,22-23H,8,13-14,16-17,26H2,1H3