4-azanyl-2-[1-(2-ethoxy-4-methoxy-phenyl)-3-oxidanyl-butyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[1-(2-ethoxy-4-methoxy-phenyl)-3-oxidanyl-butyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[1-(2-ethoxy-4-methoxy-phenyl)-3-hydroxy-butyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[1-(2-ethoxy-4-methoxyphenyl)-3-hydroxybutyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[1-(2-ethoxy-4-methoxyphenyl)-3-hydroxybutyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[1-(2-ethoxy-4-methoxy-phenyl)-3-hydroxy-butyl]isoindoline-1,3-quinone Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)OC)C(CC(C)O)N2C(=O)C3=C(C2=O)C(=CC=C3)N

Isomeric SMILES

CCOC1=C(C=CC(=C1)OC)C(CC(C)O)N2C(=O)C3=C(C2=O)C(=CC=C3)N

InChI

InChI=1S/C21H24N2O5/c1-4-28-18-11-13(27-3)8-9-14(18)17(10-12(2)24)23-20(25)15-6-5-7-16(22)19(15)21(23)26/h5-9,11-12,17,24H,4,10,22H2,1-3H3