2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: 2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoate Openeye Name: 2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-ammonio-4-methyl-1-oxopentyl)amino]-3-hydroxy-1-oxopropyl]amino]-4-methylpentanoate IUPAC Name: 2-[[2-[(2-azaniumyl-4-methylpentanoyl)amino]-3-hydroxypropanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-ammonio-4-methyl-pentanoyl)amino]-3-hydroxy-propanoyl]amino]-4-methyl-valerate Formula: C15H29N3O5 MolecularWeight: 331.40786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)CC(C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)[O-])[NH3+]

InChI

InChI=1S/C15H29N3O5/c1-8(2)5-10(16)13(20)18-12(7-19)14(21)17-11(15(22)23)6-9(3)4/h8-12,19H,5-7,16H2,1-4H3,(H,17,21)(H,18,20)(H,22,23)