lithium; 1-azanylpyrrolidin-3-one; 4-[(4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoic acid

Systemtic Name: lithium; 1-azanylpyrrolidin-3-one; 4-[(4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoic acid Openeye Name: lithium; 1-aminopyrrolidin-3-one; 4-[[3-methyl-1-(oxomethyl)butyl]carbamoyl]benzoic acid CAS Name: lithium; 1-amino-3-pyrrolidinone; 4-[[(4-methyl-1-oxopentan-2-yl)amino]-oxomethyl]benzoic acid IUPAC Name: lithium; 1-aminopyrrolidin-3-one; 4-[(4-methyl-1-oxopentan-2-yl)carbamoyl]benzoic acid Traditional Name: lithium; 1-amino-3-pyrrolidone; 4-[[1-(ketomethyl)-3-methyl-butyl]carbamoyl]benzoic acid Formula: C18H24LiN3O5 MolecularWeight: 369.34126

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC(C)CC([C-]=O)NC(=O)C1=CC=C(C=C1)C(=O)O.C1CN(CC1=O)N

Isomeric SMILES

[Li+].CC(C)CC([C-]=O)NC(=O)C1=CC=C(C=C1)C(=O)O.C1CN(CC1=O)N

InChI

InChI=1S/C14H16NO4.C4H8N2O.Li/c1-9(2)7-12(8-16)15-13(17)10-3-5-11(6-4-10)14(18)19;5-6-2-1-4(7)3-6;/h3-6,9,12H,7H2,1-2H3,(H,15,17)(H,18,19);1-3,5H2;/q-1;;+1