2,3-dihydro-1-benzofuran-3-yl 2-[(2-azanyl-3-phenyl-propanoyl)-ethanoyl-amino]-4-methyl-pentanoate

Systemtic Name: 2,3-dihydro-1-benzofuran-3-yl 2-[(2-azanyl-3-phenyl-propanoyl)-ethanoyl-amino]-4-methyl-pentanoate Openeye Name: 2,3-dihydrobenzofuran-3-yl 2-[acetyl-(2-amino-3-phenyl-propanoyl)amino]-4-methyl-pentanoate CAS Name: 2-[acetyl-(2-amino-1-oxo-3-phenylpropyl)amino]-4-methylpentanoic acid 2,3-dihydrobenzofuran-3-yl ester IUPAC Name: 2,3-dihydro-1-benzofuran-3-yl 2-[acetyl-(2-amino-3-phenylpropanoyl)amino]-4-methylpentanoate Traditional Name: 2-[acetyl(phenylalanyl)amino]-4-methyl-valeric acid coumaran-3-yl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1COC2=CC=CC=C12)N(C(=O)C)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)CC(C(=O)OC1COC2=CC=CC=C12)N(C(=O)C)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C25H30N2O5/c1-16(2)13-21(25(30)32-23-15-31-22-12-8-7-11-19(22)23)27(17(3)28)24(29)20(26)14-18-9-5-4-6-10-18/h4-12,16,20-21,23H,13-15,26H2,1-3H3