ethyl 4-[4-[(2,6-dimethylphenyl)-propanoyl-amino]butanoyl-(phenylmethyl)amino]butanoate

Systemtic Name: ethyl 4-[4-[(2,6-dimethylphenyl)-propanoyl-amino]butanoyl-(phenylmethyl)amino]butanoate Openeye Name: ethyl 4-[benzyl-[4-(2,6-dimethyl-N-propanoyl-anilino)butanoyl]amino]butanoate CAS Name: 4-[[4-[2,6-dimethyl-N-(1-oxopropyl)anilino]-1-oxobutyl]-(phenylmethyl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-[4-(2,6-dimethyl-N-propanoylanilino)butanoyl]amino]butanoate Traditional Name: 4-[benzyl-[4-(2,6-dimethyl-N-propionyl-anilino)butanoyl]amino]butyric acid ethyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCCC(=O)N(CCCC(=O)OCC)CC1=CC=CC=C1)C2=C(C=CC=C2C)C

Isomeric SMILES

CCC(=O)N(CCCC(=O)N(CCCC(=O)OCC)CC1=CC=CC=C1)C2=C(C=CC=C2C)C

InChI

InChI=1S/C28H38N2O4/c1-5-25(31)30(28-22(3)13-10-14-23(28)4)20-11-17-26(32)29(19-12-18-27(33)34-6-2)21-24-15-8-7-9-16-24/h7-10,13-16H,5-6,11-12,17-21H2,1-4H3