N-[(1-oxidanidylpyridin-1-ium-2-yl)-oxidanyl-methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(1-oxidanidylpyridin-1-ium-2-yl)-oxidanyl-methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[hydroxy-(1-oxido-2-pyridin-1-iumyl)methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC=C3)C(C4=CC=CC=[N+]4[O-])O

Isomeric SMILES

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC=C3)C(C4=CC=CC=[N+]4[O-])O

InChI

InChI=1S/C23H21N3O3/c27-22(18-13-14-24-20-11-5-4-8-17(20)16-18)26(19-9-2-1-3-10-19)23(28)21-12-6-7-15-25(21)29/h1-12,15-16,23-24,28H,13-14H2