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

Systemtic Name: ethyl 6-(2-hydroxyphenyl)-1-[3-(2-hydroxyphenyl)phenyl]-7-(phenylmethyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 7-benzyl-6-(2-hydroxyphenyl)-1-[3-(2-hydroxyphenyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 6-(2-hydroxyphenyl)-1-[3-(2-hydroxyphenyl)phenyl]-7-(phenylmethyl)-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 7-benzyl-6-(2-hydroxyphenyl)-1-[3-(2-hydroxyphenyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 7-benzyl-6-(2-hydroxyphenyl)-1-[3-(2-hydroxyphenyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C41H33N3O4 MolecularWeight: 631.71842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2C=C1CN3C=NC=N3)C4=CC=CC=C4O)CC5=CC=CC=C5)C6=CC=CC(=C6)C7=CC=CC=C7O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2C=C1CN3C=NC=N3)C4=CC=CC=C4O)CC5=CC=CC=C5)C6=CC=CC(=C6)C7=CC=CC=C7O

InChI

InChI=1S/C41H33N3O4/c1-2-48-41(47)40-32(24-44-26-42-25-43-44)21-31-22-35(34-16-7-9-18-38(34)46)30(19-27-11-4-3-5-12-27)23-36(31)39(40)29-14-10-13-28(20-29)33-15-6-8-17-37(33)45/h3-18,20-23,25-26,45-46H,2,19,24H2,1H3