methyl 2-[[2-[(4-chlorophenyl)methoxycarbonylamino]-4-methyl-pentanoyl]amino]hexanoate

Systemtic Name: methyl 2-[[2-[(4-chlorophenyl)methoxycarbonylamino]-4-methyl-pentanoyl]amino]hexanoate Openeye Name: methyl 2-[[2-[(4-chlorophenyl)methoxycarbonylamino]-4-methyl-pentanoyl]amino]hexanoate CAS Name: 2-[[2-[[(4-chlorophenyl)methoxy-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-chlorophenyl)methoxycarbonylamino]-4-methylpentanoyl]amino]hexanoate Traditional Name: 2-[[2-[(4-chlorobenzyl)oxycarbonylamino]-4-methyl-pentanoyl]amino]hexanoic acid methyl ester Formula: C21H31ClN2O5 MolecularWeight: 426.93424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)C(CC(C)C)NC(=O)OCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)C(CC(C)C)NC(=O)OCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C21H31ClN2O5/c1-5-6-7-17(20(26)28-4)23-19(25)18(12-14(2)3)24-21(27)29-13-15-8-10-16(22)11-9-15/h8-11,14,17-18H,5-7,12-13H2,1-4H3,(H,23,25)(H,24,27)