4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxyphenyl)methylamino]pyridin-1-ium-3-carbonitrile

Systemtic Name: 4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxyphenyl)methylamino]pyridin-1-ium-3-carbonitrile Openeye Name: 4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxyphenyl)methylamino]pyridin-1-ium-3-carbonitrile CAS Name: 4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxyphenyl)methylamino]-3-pyridin-1-iumcarbonitrile IUPAC Name: 4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxyphenyl)methylamino]pyridin-1-ium-3-carbonitrile Traditional Name: 4-(methoxymethyl)-6-methyl-5-nitro-2-[(3,4,5-trimethoxybenzyl)amino]pyridin-1-ium-3-carbonitrile Formula: C19H23N4O6+ MolecularWeight: 403.40912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=[NH+]1)NCC2=CC(=C(C(=C2)OC)OC)OC)C#N)COC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C(=[NH+]1)NCC2=CC(=C(C(=C2)OC)OC)OC)C#N)COC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O6/c1-11-17(23(24)25)14(10-26-2)13(8-20)19(22-11)21-9-12-6-15(27-3)18(29-5)16(7-12)28-4/h6-7H,9-10H2,1-5H3,(H,21,22)/p+1