N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide CAS Name: N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N2CCCC2C3=NC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N2CCCC2C3=NC4=C(O3)C=CC(=C4)C5=CC(=CC=C5)OC)C

InChI

InChI=1S/C27H27N3O3/c1-17-9-11-22(18(2)14-17)29-27(31)30-13-5-8-24(30)26-28-23-16-20(10-12-25(23)33-26)19-6-4-7-21(15-19)32-3/h4,6-7,9-12,14-16,24H,5,8,13H2,1-3H3,(H,29,31)