4-methyl-2-[[4-methyl-2-(prop-2-enylcarbamoylamino)pentanoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[4-methyl-2-(prop-2-enylcarbamoylamino)pentanoyl]amino]pentanoic acid Openeye Name: 2-[[2-(allylcarbamoylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid CAS Name: 4-methyl-2-[[4-methyl-1-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]pentyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[4-methyl-2-(prop-2-enylcarbamoylamino)pentanoyl]amino]pentanoic acid Traditional Name: 2-[[2-(allylcarbamoylamino)-4-methyl-pentanoyl]amino]-4-methyl-valeric acid Formula: C16H29N3O4 MolecularWeight: 327.41916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)O)NC(=O)NCC=C

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(C)C)C(=O)O)NC(=O)NCC=C

InChI

InChI=1S/C16H29N3O4/c1-6-7-17-16(23)19-12(8-10(2)3)14(20)18-13(15(21)22)9-11(4)5/h6,10-13H,1,7-9H2,2-5H3,(H,18,20)(H,21,22)(H2,17,19,23)