methyl 3-[3-(5-chloranylbenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-oxidanyl-phenyl]propanoate

Systemtic Name: methyl 3-[3-(5-chloranylbenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-oxidanyl-phenyl]propanoate Openeye Name: methyl 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxy-phenyl]propanoate CAS Name: 3-[3-(5-chloro-2-benzotriazolyl)-5-(1,1-diphenylethyl)-4-hydroxyphenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxyphenyl]propanoate Traditional Name: 3-[3-(5-chlorobenzotriazol-2-yl)-5-(1,1-diphenylethyl)-4-hydroxy-phenyl]propionic acid methyl ester Formula: C30H26ClN3O3 MolecularWeight: 511.99874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=C(C(=CC(=C3)CCC(=O)OC)N4N=C5C=CC(=CC5=N4)Cl)O

Isomeric SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=C(C(=CC(=C3)CCC(=O)OC)N4N=C5C=CC(=CC5=N4)Cl)O

InChI

InChI=1S/C30H26ClN3O3/c1-30(21-9-5-3-6-10-21,22-11-7-4-8-12-22)24-17-20(13-16-28(35)37-2)18-27(29(24)36)34-32-25-15-14-23(31)19-26(25)33-34/h3-12,14-15,17-19,36H,13,16H2,1-2H3