5-azanyl-2-[[(3-ethanoylphenyl)amino]methyl]isoindole-1,3-dione

Systemtic Name: 5-azanyl-2-[[(3-ethanoylphenyl)amino]methyl]isoindole-1,3-dione Openeye Name: 2-[(3-acetylanilino)methyl]-5-amino-isoindoline-1,3-dione CAS Name: 2-[(3-acetylanilino)methyl]-5-aminoisoindole-1,3-dione IUPAC Name: 2-[(3-acetylanilino)methyl]-5-aminoisoindole-1,3-dione Traditional Name: 2-[(3-acetylanilino)methyl]-5-amino-isoindoline-1,3-quinone Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NCN2C(=O)C3=C(C2=O)C=C(C=C3)N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NCN2C(=O)C3=C(C2=O)C=C(C=C3)N

InChI

InChI=1S/C17H15N3O3/c1-10(21)11-3-2-4-13(7-11)19-9-20-16(22)14-6-5-12(18)8-15(14)17(20)23/h2-8,19H,9,18H2,1H3