(3R)-3-[(2-methylphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-[(2-methylphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-(o-tolylcarbamoylamino)-4-(trimethylammonio)butanoate CAS Name: (3R)-3-[[(2-methylanilino)-oxomethyl]amino]-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-[(2-methylphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-(o-tolylcarbamoylamino)-4-(trimethylammonio)butyrate Formula: C15H23N3O3 MolecularWeight: 293.36142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC(CC(=O)[O-])C[N+](C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N[C@H](CC(=O)[O-])C[N+](C)(C)C

InChI

InChI=1S/C15H23N3O3/c1-11-7-5-6-8-13(11)17-15(21)16-12(9-14(19)20)10-18(2,3)4/h5-8,12H,9-10H2,1-4H3,(H2-,16,17,19,20,21)/t12-/m1/s1