2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-(3-methylphenoxy)isoindole-1,3-dione

Systemtic Name: 2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-(3-methylphenoxy)isoindole-1,3-dione Openeye Name: 2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-(3-methylphenoxy)isoindoline-1,3-dione CAS Name: 2-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-5-(3-methylphenoxy)isoindole-1,3-dione IUPAC Name: 2-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-5-(3-methylphenoxy)isoindole-1,3-dione Traditional Name: 2-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]-5-(3-methylphenoxy)isoindoline-1,3-quinone Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=C(C=C4)OCCN5CCCC5)OC

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=C(C=C4)OCCN5CCCC5)OC

InChI

InChI=1S/C28H28N2O5/c1-19-6-5-7-21(16-19)35-22-9-10-23-24(18-22)28(32)30(27(23)31)20-8-11-25(26(17-20)33-2)34-15-14-29-12-3-4-13-29/h5-11,16-18H,3-4,12-15H2,1-2H3