methyl 2-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]butanoate

Systemtic Name: methyl 2-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]butanoate Openeye Name: methyl 2-[[1-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]butanoate CAS Name: 2-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]butanoic acid methyl ester IUPAC Name: methyl 2-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]butanoate Traditional Name: 2-[[1-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-3-methyl-butyl]amino]butyric acid methyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O4/c1-6-16(21(27)28-5)23-17(12-14(2)3)20(26)24-18(19(25)22-4)13-15-10-8-7-9-11-15/h7-11,14,16-18,23H,6,12-13H2,1-5H3,(H,22,25)(H,24,26)