N-[2-(3,4-dimethylphenoxy)-5-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-1,3-dihydroisoindole-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenoxy)-5-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-1,3-dihydroisoindole-2-carboxamide Openeye Name: N-[2-(3,4-dimethylphenoxy)-5-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]isoindoline-2-carboxamide CAS Name: N-[2-(3,4-dimethylphenoxy)-5-[oxo-[2-(1-pyrrolidinyl)ethylamino]methyl]phenyl]-1,3-dihydroisoindole-2-carboxamide IUPAC Name: N-[2-(3,4-dimethylphenoxy)-5-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-1,3-dihydroisoindole-2-carboxamide Traditional Name: N-[2-(3,4-dimethylphenoxy)-5-(2-pyrrolidinoethylcarbamoyl)phenyl]isoindoline-2-carboxamide Formula: C30H34N4O3 MolecularWeight: 498.61596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(=O)NCCN3CCCC3)NC(=O)N4CC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(=O)NCCN3CCCC3)NC(=O)N4CC5=CC=CC=C5C4)C

InChI

InChI=1S/C30H34N4O3/c1-21-9-11-26(17-22(21)2)37-28-12-10-23(29(35)31-13-16-33-14-5-6-15-33)18-27(28)32-30(36)34-19-24-7-3-4-8-25(24)20-34/h3-4,7-12,17-18H,5-6,13-16,19-20H2,1-2H3,(H,31,35)(H,32,36)