ethyl 3-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]-2-oxidanylidene-pentanoate

Systemtic Name: ethyl 3-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]-2-oxidanylidene-pentanoate Openeye Name: ethyl 3-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]-2-oxo-pentanoate CAS Name: 3-[[4-methyl-1-oxo-2-[(1-oxo-4-phenylbutyl)amino]pentyl]amino]-2-oxopentanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]-2-oxopentanoate Traditional Name: 2-keto-3-[[4-methyl-2-(4-phenylbutanoylamino)pentanoyl]amino]valeric acid ethyl ester Formula: C23H34N2O5 MolecularWeight: 418.52646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C(=O)OCC)NC(=O)C(CC(C)C)NC(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CCC(C(=O)C(=O)OCC)NC(=O)C(CC(C)C)NC(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C23H34N2O5/c1-5-18(21(27)23(29)30-6-2)25-22(28)19(15-16(3)4)24-20(26)14-10-13-17-11-8-7-9-12-17/h7-9,11-12,16,18-19H,5-6,10,13-15H2,1-4H3,(H,24,26)(H,25,28)