4-[5-[4,7-bis(chloranyl)-1-benzothiophen-2-yl]-1H-pyrrol-2-yl]naphthalene-1-carboxylic acid

Systemtic Name: 4-[5-[4,7-bis(chloranyl)-1-benzothiophen-2-yl]-1H-pyrrol-2-yl]naphthalene-1-carboxylic acid Openeye Name: 4-[5-(4,7-dichlorobenzothiophen-2-yl)-1H-pyrrol-2-yl]naphthalene-1-carboxylic acid CAS Name: 4-[5-(4,7-dichloro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]-1-naphthalenecarboxylic acid IUPAC Name: 4-[5-(4,7-dichloro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]naphthalene-1-carboxylic acid Traditional Name: 4-[5-(4,7-dichlorobenzothiophen-2-yl)-1H-pyrrol-2-yl]-1-naphthoic acid Formula: C23H13Cl2NO2S MolecularWeight: 438.32582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2C(=O)O)C3=CC=C(N3)C4=CC5=C(C=CC(=C5S4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2C(=O)O)C3=CC=C(N3)C4=CC5=C(C=CC(=C5S4)Cl)Cl

InChI

InChI=1S/C23H13Cl2NO2S/c24-17-7-8-18(25)22-16(17)11-21(29-22)20-10-9-19(26-20)14-5-6-15(23(27)28)13-4-2-1-3-12(13)14/h1-11,26H,(H,27,28)