(2R,3S)-3-benzamido-2-oxidanyl-3-phenyl-propanoic acid; furan-2-ylmethanamine

Systemtic Name: (2R,3S)-3-benzamido-2-oxidanyl-3-phenyl-propanoic acid; furan-2-ylmethanamine Openeye Name: (2R,3S)-3-benzamido-2-hydroxy-3-phenyl-propanoic acid; 2-furylmethanamine CAS Name: (2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoic acid; 2-furanylmethanamine IUPAC Name: (2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoic acid; furan-2-ylmethanamine Traditional Name: (2R,3S)-3-benzamido-2-hydroxy-3-phenyl-propionic acid; 2-furfurylamine Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)O)O)NC(=O)C2=CC=CC=C2.C1=COC(=C1)CN

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]([C@H](C(=O)O)O)NC(=O)C2=CC=CC=C2.C1=COC(=C1)CN

InChI

InChI=1S/C16H15NO4.C5H7NO/c18-14(16(20)21)13(11-7-3-1-4-8-11)17-15(19)12-9-5-2-6-10-12;6-4-5-2-1-3-7-5/h1-10,13-14,18H,(H,17,19)(H,20,21);1-3H,4,6H2/t13-,14+;/m0./s1