(2R,4R)-2-azanyl-4-[(3-chloranyl-1-benzothiophen-2-yl)methyl]pentanedioic acid

Systemtic Name: (2R,4R)-2-azanyl-4-[(3-chloranyl-1-benzothiophen-2-yl)methyl]pentanedioic acid Openeye Name: (2R,4R)-2-amino-4-[(3-chlorobenzothiophen-2-yl)methyl]pentanedioic acid CAS Name: (2R,4R)-2-amino-4-[(3-chloro-1-benzothiophen-2-yl)methyl]pentanedioic acid IUPAC Name: (2R,4R)-2-amino-4-[(3-chloro-1-benzothiophen-2-yl)methyl]pentanedioic acid Traditional Name: (2R,4R)-2-amino-4-[(3-chlorobenzothiophen-2-yl)methyl]glutaric acid Formula: C14H14ClNO4S MolecularWeight: 327.78326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)CC(CC(C(=O)O)N)C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C[C@@H](C[C@H](C(=O)O)N)C(=O)O)Cl

InChI

InChI=1S/C14H14ClNO4S/c15-12-8-3-1-2-4-10(8)21-11(12)6-7(13(17)18)5-9(16)14(19)20/h1-4,7,9H,5-6,16H2,(H,17,18)(H,19,20)/t7-,9-/m1/s1