(2R)-2-azanyl-3-[(2-methoxy-9H-xanthen-9-yl)sulfanyl]propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[(2-methoxy-9H-xanthen-9-yl)sulfanyl]propanoic acid Openeye Name: (2R)-2-amino-3-[(2-methoxy-9H-xanthen-9-yl)sulfanyl]propanoic acid CAS Name: (2R)-2-amino-3-[(2-methoxy-9H-xanthen-9-yl)thio]propanoic acid IUPAC Name: (2R)-2-amino-3-[(2-methoxy-9H-xanthen-9-yl)sulfanyl]propanoic acid Traditional Name: (2R)-2-amino-3-[(2-methoxy-9H-xanthen-9-yl)thio]propionic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC=CC=C3C2SCC(C(=O)O)N

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC=CC=C3C2SC[C@@H](C(=O)O)N

InChI

InChI=1S/C17H17NO4S/c1-21-10-6-7-15-12(8-10)16(23-9-13(18)17(19)20)11-4-2-3-5-14(11)22-15/h2-8,13,16H,9,18H2,1H3,(H,19,20)/t13-,16?/m0/s1