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

Systemtic Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-7-iodanyl-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Openeye Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-7-iodo-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate CAS Name: 1-[3-(2-hydroxyphenyl)phenyl]-7-iodo-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)-2-naphthalenecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-hydroxyphenyl)phenyl]-7-iodo-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylate Traditional Name: 1-[3-(2-hydroxyphenyl)phenyl]-7-iodo-6-methoxy-3-(1,2,4-triazol-1-ylmethyl)naphthalene-2-carboxylic acid ethyl ester Formula: C29H24IN3O4 MolecularWeight: 605.42303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC=CC(=C3)C4=CC=CC=C4O)I)OC)CN5C=NC=N5

Isomeric SMILES

CCOC(=O)C1=C(C=C2C=C(C(=CC2=C1C3=CC=CC(=C3)C4=CC=CC=C4O)I)OC)CN5C=NC=N5

InChI

InChI=1S/C29H24IN3O4/c1-3-37-29(35)28-21(15-33-17-31-16-32-33)12-20-13-26(36-2)24(30)14-23(20)27(28)19-8-6-7-18(11-19)22-9-4-5-10-25(22)34/h4-14,16-17,34H,3,15H2,1-2H3