2-aminocarbonyl-4-[2-[[(2R)-4-phenylbutan-2-yl]azaniumyl]ethanoyl]phenolate

Systemtic Name: 2-aminocarbonyl-4-[2-[[(2R)-4-phenylbutan-2-yl]azaniumyl]ethanoyl]phenolate Openeye Name: 2-carbamoyl-4-[2-[[(1R)-1-methyl-3-phenyl-propyl]ammonio]acetyl]phenolate CAS Name: 2-carbamoyl-4-[1-oxo-2-[[(2R)-4-phenylbutan-2-yl]ammonio]ethyl]phenolate IUPAC Name: 2-carbamoyl-4-[2-[[(2R)-4-phenylbutan-2-yl]azaniumyl]acetyl]phenolate Traditional Name: 2-carbamoyl-4-[2-[[(1R)-1-methyl-3-phenyl-propyl]ammonio]acetyl]phenolate Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH2+]CC(=O)C2=CC(=C(C=C2)[O-])C(=O)N

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH2+]CC(=O)C2=CC(=C(C=C2)[O-])C(=O)N

InChI

InChI=1S/C19H22N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,21-22H,7-8,12H2,1H3,(H2,20,24)/t13-/m1/s1