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

Systemtic Name: ethyl 6-(2-hydroxyphenyl)-7-(phenylmethyl)-1-[3-(phenylmethyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 7-benzyl-1-(3-benzylphenyl)-6-(2-hydroxyphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 6-(2-hydroxyphenyl)-7-(phenylmethyl)-1-[3-(phenylmethyl)phenyl]-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 7-benzyl-1-(3-benzylphenyl)-6-(2-hydroxyphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 7-benzyl-1-(3-benzylphenyl)-6-(2-hydroxyphenyl)-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C42H35N3O3 MolecularWeight: 629.7456

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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)CC7=CC=CC=C7

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)CC7=CC=CC=C7

InChI

InChI=1S/C42H35N3O3/c1-2-48-42(47)41-35(26-45-28-43-27-44-45)23-34-24-37(36-18-9-10-19-39(36)46)33(21-30-14-7-4-8-15-30)25-38(34)40(41)32-17-11-16-31(22-32)20-29-12-5-3-6-13-29/h3-19,22-25,27-28,46H,2,20-21,26H2,1H3