methyl 7-[[3-methyl-2-[(3-methylphenyl)carbonylamino]butanoyl]amino]heptanoate

Systemtic Name: methyl 7-[[3-methyl-2-[(3-methylphenyl)carbonylamino]butanoyl]amino]heptanoate Openeye Name: methyl 7-[[3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]heptanoate CAS Name: 7-[[3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxobutyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]heptanoate Traditional Name: 7-[[3-methyl-2-(m-toluoylamino)butanoyl]amino]enanthic acid methyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C21H32N2O4/c1-15(2)19(23-20(25)17-11-9-10-16(3)14-17)21(26)22-13-8-6-5-7-12-18(24)27-4/h9-11,14-15,19H,5-8,12-13H2,1-4H3,(H,22,26)(H,23,25)