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

Systemtic Name: N-(3-methylphenyl)-N-[(1-oxidanidylpyridin-1-ium-2-yl)-oxidanyl-methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-(m-tolyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[hydroxy-(1-oxido-2-pyridin-1-iumyl)methyl]-N-(3-methylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-(3-methylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-(m-tolyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C(C2=CC=CC=[N+]2[O-])O)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CC1=CC(=CC=C1)N(C(C2=CC=CC=[N+]2[O-])O)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C24H23N3O3/c1-17-7-6-9-20(15-17)27(24(29)22-11-4-5-14-26(22)30)23(28)19-12-13-25-21-10-3-2-8-18(21)16-19/h2-11,14-16,24-25,29H,12-13H2,1H3