2-[5-(furan-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-(furan-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindole-1,3-dione Openeye Name: 2-[5-(2-furyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindoline-1,3-dione CAS Name: 2-[5-(2-furanyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(furan-2-yl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindole-1,3-dione Traditional Name: 2-[5-(2-furyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]isoindoline-1,3-quinone Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=CC=CC=C21)C3=CC=CO3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CN1C(CN=C(C2=CC=CC=C21)C3=CC=CO3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H17N3O3/c1-24-17-10-5-4-9-16(17)20(18-11-6-12-28-18)23-13-19(24)25-21(26)14-7-2-3-8-15(14)22(25)27/h2-12,19H,13H2,1H3