4-[5-(8-ethyl-5-methoxy-naphthalen-2-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(8-ethyl-5-methoxy-naphthalen-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(8-ethyl-5-methoxy-2-naphthyl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(8-ethyl-5-methoxy-2-naphthalenyl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(8-ethyl-5-methoxynaphthalen-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(8-ethyl-5-methoxy-2-naphthyl)-1H-pyrrol-2-yl]benzoic acid Formula: C24H21NO3 MolecularWeight: 371.42844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=C(C=CC2=C(C=C1)OC)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCC1=C2C=C(C=CC2=C(C=C1)OC)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H21NO3/c1-3-15-9-13-23(28-2)19-10-8-18(14-20(15)19)22-12-11-21(25-22)16-4-6-17(7-5-16)24(26)27/h4-14,25H,3H2,1-2H3,(H,26,27)