N-[4-methyl-2-[5-methyl-1-(phenylcarbonyl)-1,2-diazepin-3-yl]pyridin-1-ium-1-yl]benzamide

Systemtic Name: N-[4-methyl-2-[5-methyl-1-(phenylcarbonyl)-1,2-diazepin-3-yl]pyridin-1-ium-1-yl]benzamide Openeye Name: N-[2-(1-benzoyl-5-methyl-diazepin-3-yl)-4-methyl-pyridin-1-ium-1-yl]benzamide CAS Name: N-[2-(1-benzoyl-5-methyl-3-diazepinyl)-4-methyl-1-pyridin-1-iumyl]benzamide IUPAC Name: N-[2-(1-benzoyl-5-methyldiazepin-3-yl)-4-methylpyridin-1-ium-1-yl]benzamide Traditional Name: N-[2-(1-benzoyl-5-methyl-diazepin-3-yl)-4-methyl-pyridin-1-ium-1-yl]benzamide Formula: C26H23N4O2+ MolecularWeight: 423.48642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN(C=C1)C(=O)C2=CC=CC=C2)C3=[N+](C=CC(=C3)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN(C=C1)C(=O)C2=CC=CC=C2)C3=[N+](C=CC(=C3)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H22N4O2/c1-19-14-16-30(26(32)22-11-7-4-8-12-22)27-23(17-19)24-18-20(2)13-15-29(24)28-25(31)21-9-5-3-6-10-21/h3-18H,1-2H3/p+1