ethyl 7-(2-hydroxyphenyl)-6-methoxy-1-[3-(phenylmethyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate

Systemtic Name: ethyl 7-(2-hydroxyphenyl)-6-methoxy-1-[3-(phenylmethyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 1-(3-benzylphenyl)-7-(2-hydroxyphenyl)-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 7-(2-hydroxyphenyl)-6-methoxy-1-[3-(phenylmethyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-benzylphenyl)-7-(2-hydroxyphenyl)-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 1-(3-benzylphenyl)-7-(2-hydroxyphenyl)-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C36H31N3O4 MolecularWeight: 569.64904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2C=C1CN3C=NC=N3)OC)C4=CC=CC=C4O)C5=CC(=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2C=C1CN3C=NC=N3)OC)C4=CC=CC=C4O)C5=CC(=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C36H31N3O4/c1-3-43-36(41)35-28(21-39-23-37-22-38-39)18-27-19-33(42-2)31(29-14-7-8-15-32(29)40)20-30(27)34(35)26-13-9-12-25(17-26)16-24-10-5-4-6-11-24/h4-15,17-20,22-23,40H,3,16,21H2,1-2H3