4-(phenylmethyl)thieno[2,3-b]indole-2-carboxylic acid

Systemtic Name: 4-(phenylmethyl)thieno[2,3-b]indole-2-carboxylic acid Openeye Name: 4-benzylthieno[2,3-b]indole-2-carboxylic acid CAS Name: 4-(phenylmethyl)-2-thieno[2,3-b]indolecarboxylic acid IUPAC Name: 4-benzylthieno[2,3-b]indole-2-carboxylic acid Traditional Name: 4-benzylthien[2,3-b]indole-2-carboxylic acid Formula: C18H13NO2S MolecularWeight: 307.36632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2SC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2SC(=C4)C(=O)O

InChI

InChI=1S/C18H13NO2S/c20-18(21)16-10-14-13-8-4-5-9-15(13)19(17(14)22-16)11-12-6-2-1-3-7-12/h1-10H,11H2,(H,20,21)