sodium 3-[(4-methyl-1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)carbamoyl]aziridine-2-carboxylic acid

Systemtic Name: sodium 3-[(4-methyl-1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)carbamoyl]aziridine-2-carboxylic acid Openeye Name: sodium 3-[[3-methyl-1-(piperidine-1-carbonyl)butyl]carbamoyl]aziridine-2-carboxylic acid CAS Name: sodium 3-[[[4-methyl-1-oxo-1-(1-piperidinyl)pentan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid IUPAC Name: sodium 3-[(4-methyl-1-oxo-1-piperidin-1-ylpentan-2-yl)carbamoyl]aziridine-2-carboxylic acid Traditional Name: sodium 3-[[3-methyl-1-(piperidine-1-carbonyl)butyl]carbamoyl]ethylenimine-2-carboxylic acid Formula: C15H25N3NaO4+ MolecularWeight: 334.36647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCCC1)NC(=O)C2C(N2)C(=O)O.[Na+]

Isomeric SMILES

CC(C)CC(C(=O)N1CCCCC1)NC(=O)C2C(N2)C(=O)O.[Na+]

InChI

InChI=1S/C15H25N3O4.Na/c1-9(2)8-10(14(20)18-6-4-3-5-7-18)16-13(19)11-12(17-11)15(21)22;/h9-12,17H,3-8H2,1-2H3,(H,16,19)(H,21,22);/q;+1