(1S)-1-(3-bromophenyl)ethanamine; (2S)-2-naphthalen-2-yl-2-oxidanyl-ethanoic acid

Systemtic Name: (1S)-1-(3-bromophenyl)ethanamine; (2S)-2-naphthalen-2-yl-2-oxidanyl-ethanoic acid Openeye Name: (1S)-1-(3-bromophenyl)ethanamine; (2S)-2-hydroxy-2-(2-naphthyl)acetic acid CAS Name: (1S)-1-(3-bromophenyl)ethanamine; (2S)-2-hydroxy-2-(2-naphthalenyl)acetic acid IUPAC Name: (1S)-1-(3-bromophenyl)ethanamine; (2S)-2-hydroxy-2-naphthalen-2-ylacetic acid Traditional Name: [(1S)-1-(3-bromophenyl)ethyl]amine; (2S)-2-hydroxy-2-(2-naphthyl)acetic acid Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)N.C1=CC=C2C=C(C=CC2=C1)C(C(=O)O)O

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)Br)N.C1=CC=C2C=C(C=CC2=C1)[C@@H](C(=O)O)O

InChI

InChI=1S/C12H10O3.C8H10BrN/c13-11(12(14)15)10-6-5-8-3-1-2-4-9(8)7-10;1-6(10)7-3-2-4-8(9)5-7/h1-7,11,13H,(H,14,15);2-6H,10H2,1H3/t11-;6-/m00/s1