[(2S)-2-(3-aminocarbonyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]-[(2S)-4-phenylbutan-2-yl]azanium

Systemtic Name: [(2S)-2-(3-aminocarbonyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]-[(2S)-4-phenylbutan-2-yl]azanium Openeye Name: [(2S)-2-(3-carbamoyl-4-hydroxy-phenyl)-2-hydroxy-ethyl]-[(1S)-1-methyl-3-phenyl-propyl]ammonium CAS Name: [(2S)-2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]-[(2S)-4-phenylbutan-2-yl]ammonium IUPAC Name: [(2S)-2-(3-carbamoyl-4-hydroxyphenyl)-2-hydroxyethyl]-[(2S)-4-phenylbutan-2-yl]azanium Traditional Name: [(2S)-2-(3-carbamoyl-4-hydroxy-phenyl)-2-hydroxy-ethyl]-[(1S)-1-methyl-3-phenyl-propyl]ammonium Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3/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/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)/p+1/t13-,18+/m0/s1