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

Systemtic Name: 4-[5-(5-methoxy-8-prop-1-en-2-yl-naphthalen-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(8-isopropenyl-5-methoxy-2-naphthyl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-[5-methoxy-8-(1-methylethenyl)-2-naphthalenyl]-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(5-methoxy-8-prop-1-en-2-ylnaphthalen-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(8-isopropenyl-5-methoxy-2-naphthyl)-1H-pyrrol-2-yl]benzoic acid Formula: C25H21NO3 MolecularWeight: 383.43914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21NO3/c1-15(2)19-10-13-24(29-3)20-9-8-18(14-21(19)20)23-12-11-22(26-23)16-4-6-17(7-5-16)25(27)28/h4-14,26H,1H2,2-3H3,(H,27,28)