2-(3-azanylpropyl)-4-(3-cyclopentyloxy-4-methoxy-phenyl)isoindole-1,3-dione

Systemtic Name: 2-(3-azanylpropyl)-4-(3-cyclopentyloxy-4-methoxy-phenyl)isoindole-1,3-dione Openeye Name: 2-(3-aminopropyl)-4-[3-(cyclopentoxy)-4-methoxy-phenyl]isoindoline-1,3-dione CAS Name: 2-(3-aminopropyl)-4-(3-cyclopentyloxy-4-methoxyphenyl)isoindole-1,3-dione IUPAC Name: 2-(3-aminopropyl)-4-(3-cyclopentyloxy-4-methoxyphenyl)isoindole-1,3-dione Traditional Name: 2-(3-aminopropyl)-4-[3-(cyclopentoxy)-4-methoxy-phenyl]isoindoline-1,3-quinone Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C3C(=CC=C2)C(=O)N(C3=O)CCCN)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C3C(=CC=C2)C(=O)N(C3=O)CCCN)OC4CCCC4

InChI

InChI=1S/C23H26N2O4/c1-28-19-11-10-15(14-20(19)29-16-6-2-3-7-16)17-8-4-9-18-21(17)23(27)25(22(18)26)13-5-12-24/h4,8-11,14,16H,2-3,5-7,12-13,24H2,1H3