[3-methyl-6,11-bis(oxidanylidene)-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl] ethanoate

Systemtic Name: [3-methyl-6,11-bis(oxidanylidene)-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl] ethanoate Openeye Name: (3-methyl-6,11-dioxo-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl) acetate CAS Name: acetic acid (3-methyl-6,11-dioxo-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl) ester IUPAC Name: (3-methyl-6,11-dioxo-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl) acetate Traditional Name: acetic acid (6,11-diketo-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-4-yl) ester Formula: C15H16N2O4 MolecularWeight: 288.29854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N3CCCC3C(=O)N2)OC(=O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N3CCCC3C(=O)N2)OC(=O)C

InChI

InChI=1S/C15H16N2O4/c1-8-5-6-10-12(13(8)21-9(2)18)16-14(19)11-4-3-7-17(11)15(10)20/h5-6,11H,3-4,7H2,1-2H3,(H,16,19)