ethyl 2-[2-azanylpropanoyl-(2-hexanoylphenyl)amino]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[2-azanylpropanoyl-(2-hexanoylphenyl)amino]-4-methyl-pentanoate Openeye Name: ethyl 2-[N-(2-aminopropanoyl)-2-hexanoyl-anilino]-4-methyl-pentanoate CAS Name: 2-[N-(2-amino-1-oxopropyl)-2-(1-oxohexyl)anilino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[N-(2-aminopropanoyl)-2-hexanoylanilino]-4-methylpentanoate Traditional Name: 2-(N-alanyl-2-caproyl-anilino)-4-methyl-valeric acid ethyl ester Formula: C23H36N2O4 MolecularWeight: 404.54294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=CC=C1N(C(CC(C)C)C(=O)OCC)C(=O)C(C)N

Isomeric SMILES

CCCCCC(=O)C1=CC=CC=C1N(C(CC(C)C)C(=O)OCC)C(=O)C(C)N

InChI

InChI=1S/C23H36N2O4/c1-6-8-9-14-21(26)18-12-10-11-13-19(18)25(22(27)17(5)24)20(15-16(3)4)23(28)29-7-2/h10-13,16-17,20H,6-9,14-15,24H2,1-5H3