1-oxidanidyl-5-phenyl-1-piperidin-4-yl-2,3-dihydro-1,4-benzodiazepin-1-ium

Systemtic Name: 1-oxidanidyl-5-phenyl-1-piperidin-4-yl-2,3-dihydro-1,4-benzodiazepin-1-ium Openeye Name: 1-oxido-5-phenyl-1-(4-piperidyl)-2,3-dihydro-1,4-benzodiazepin-1-ium CAS Name: 1-oxido-5-phenyl-1-(4-piperidinyl)-2,3-dihydro-1,4-benzodiazepin-1-ium IUPAC Name: 1-oxido-5-phenyl-1-piperidin-4-yl-2,3-dihydro-1,4-benzodiazepin-1-ium Traditional Name: 1-oxido-5-phenyl-1-(4-piperidyl)-2,3-dihydro-1,4-benzodiazepin-1-ium Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1[N+]2(CCN=C(C3=CC=CC=C32)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1CNCCC1[N+]2(CCN=C(C3=CC=CC=C32)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C20H23N3O/c24-23(17-10-12-21-13-11-17)15-14-22-20(16-6-2-1-3-7-16)18-8-4-5-9-19(18)23/h1-9,17,21H,10-15H2