[2-[(4aR)-5,11-bis(oxidanylidene)-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-[(4aR)-5,11-bis(oxidanylidene)-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(4aR)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(4aR)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxoethyl]-methylammonium IUPAC Name: [2-[(4aR)-5,11-dioxo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-oxoethyl]-methylazanium Traditional Name: [2-[(4aR)-5,11-diketo-2,4,4a,6-tetrahydro-1H-pyrazino[2,1-c][1,4]benzodiazepin-3-yl]-2-keto-ethyl]-methyl-ammonium Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(=O)N1CCN2C(C1)C(=O)NC3=CC=CC=C3C2=O

Isomeric SMILES

C[NH2+]CC(=O)N1CCN2[C@H](C1)C(=O)NC3=CC=CC=C3C2=O

InChI

InChI=1S/C15H18N4O3/c1-16-8-13(20)18-6-7-19-12(9-18)14(21)17-11-5-3-2-4-10(11)15(19)22/h2-5,12,16H,6-9H2,1H3,(H,17,21)/p+1/t12-/m1/s1