(5R)-7-bromanyl-4-(2-morpholin-4-ium-4-ylethanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: (5R)-7-bromanyl-4-(2-morpholin-4-ium-4-ylethanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: (5R)-7-bromo-4-(2-morpholin-4-ium-4-ylacetyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: (5R)-7-bromo-4-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: (5R)-7-bromo-4-(2-morpholin-4-ium-4-ylacetyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: (5R)-7-bromo-4-(2-morpholin-4-ium-4-ylacetyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H23BrN3O3+ MolecularWeight: 445.32962

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br

Isomeric SMILES

C1COCC[NH+]1CC(=O)N2CC(=O)NC3=C([C@H]2C4=CC=CC=C4)C=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O3/c22-16-6-7-18-17(12-16)21(15-4-2-1-3-5-15)25(13-19(26)23-18)20(27)14-24-8-10-28-11-9-24/h1-7,12,21H,8-11,13-14H2,(H,23,26)/p+1/t21-/m1/s1