(3R)-4-phenyl-3-pyrrolidin-1-ium-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: (3R)-4-phenyl-3-pyrrolidin-1-ium-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: (3R)-4-phenyl-3-pyrrolidin-1-ium-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: (3R)-4-phenyl-3-(1-pyrrolidin-1-iumyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: (3R)-4-phenyl-3-pyrrolidin-1-ium-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: (3R)-4-phenyl-3-pyrrolidin-1-ium-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C19H20N3O+ MolecularWeight: 306.3816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2C(=NC3=CC=CC=C3NC2=O)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H]2C(=NC3=CC=CC=C3NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O/c23-19-18(22-12-6-7-13-22)17(14-8-2-1-3-9-14)20-15-10-4-5-11-16(15)21-19/h1-5,8-11,18H,6-7,12-13H2,(H,21,23)/p+1/t18-/m1/s1