methyl 5-[[2-[[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[2-[[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[isobutyl-[2-[[2-(4-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: 5-[[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-(2-methylpropyl)amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[2-[[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]-(2-methylpropyl)amino]-5-oxopentanoate Traditional Name: 5-[isobutyl-[2-keto-2-[[2-keto-2-(p-toluidino)ethyl]amino]ethyl]amino]-5-keto-valeric acid methyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CNC(=O)CN(CC(C)C)C(=O)CCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CNC(=O)CN(CC(C)C)C(=O)CCCC(=O)OC

InChI

InChI=1S/C21H31N3O5/c1-15(2)13-24(20(27)6-5-7-21(28)29-4)14-19(26)22-12-18(25)23-17-10-8-16(3)9-11-17/h8-11,15H,5-7,12-14H2,1-4H3,(H,22,26)(H,23,25)