2-[(4aS)-9-(4-chlorophenyl)-5,11-bis(oxidanylidene)-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-[(4aS)-9-(4-chlorophenyl)-5,11-bis(oxidanylidene)-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-[(4aS)-9-(4-chlorophenyl)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxo-acetamide CAS Name: 2-[(4aS)-9-(4-chlorophenyl)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxoacetamide IUPAC Name: 2-[(4aS)-9-(4-chlorophenyl)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxoacetamide Traditional Name: 2-[(4aS)-9-(4-chlorophenyl)-5,11-diketo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-keto-acetamide Formula: C20H17ClN4O4 MolecularWeight: 412.82638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN1C(=O)C(=O)N)C(=O)NC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN2[C@@H](CN1C(=O)C(=O)N)C(=O)NC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H17ClN4O4/c21-13-4-1-11(2-5-13)12-3-6-15-14(9-12)19(28)25-8-7-24(20(29)17(22)26)10-16(25)18(27)23-15/h1-6,9,16H,7-8,10H2,(H2,22,26)(H,23,27)/t16-/m0/s1