4-butyl-5-methoxy-benzo[e]isoindole-1,3-dione

Systemtic Name: 4-butyl-5-methoxy-benzo[e]isoindole-1,3-dione Openeye Name: 4-butyl-5-methoxy-benzo[e]isoindole-1,3-dione CAS Name: 4-butyl-5-methoxybenzo[e]isoindole-1,3-dione IUPAC Name: 4-butyl-5-methoxybenzo[e]isoindole-1,3-dione Traditional Name: 4-butyl-5-methoxy-benz[e]isoindole-1,3-quinone Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C3=C1C(=O)NC3=O)OC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C3=C1C(=O)NC3=O)OC

InChI

InChI=1S/C17H17NO3/c1-3-4-7-12-14-13(16(19)18-17(14)20)10-8-5-6-9-11(10)15(12)21-2/h5-6,8-9H,3-4,7H2,1-2H3,(H,18,19,20)