2-[[2-[(3-azanyl-5-methyl-2-oxidanyl-hexyl)amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(3-azanyl-5-methyl-2-oxidanyl-hexyl)amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[(3-amino-2-hydroxy-5-methyl-hexyl)amino]-4-methyl-pentanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[(3-amino-2-hydroxy-5-methylhexyl)amino]-4-methyl-1-oxopentyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[(3-amino-2-hydroxy-5-methylhexyl)amino]-4-methylpentanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[(3-amino-2-hydroxy-5-methyl-hexyl)amino]-4-methyl-pentanoyl]amino]-3-methyl-butyric acid Formula: C18H37N3O4 MolecularWeight: 359.50408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CNC(CC(C)C)C(=O)NC(C(C)C)C(=O)O)O)N

Isomeric SMILES

CC(C)CC(C(CNC(CC(C)C)C(=O)NC(C(C)C)C(=O)O)O)N

InChI

InChI=1S/C18H37N3O4/c1-10(2)7-13(19)15(22)9-20-14(8-11(3)4)17(23)21-16(12(5)6)18(24)25/h10-16,20,22H,7-9,19H2,1-6H3,(H,21,23)(H,24,25)