(6-methoxynaphthalen-2-yl)methyl-methyl-[[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]azanium

Systemtic Name: (6-methoxynaphthalen-2-yl)methyl-methyl-[[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]azanium Openeye Name: (6-methoxy-2-naphthyl)methyl-methyl-[(4-nitro-1,3-dioxo-isoindolin-2-yl)methyl]ammonium CAS Name: (6-methoxy-2-naphthalenyl)methyl-methyl-[(4-nitro-1,3-dioxo-2-isoindolyl)methyl]ammonium IUPAC Name: (6-methoxynaphthalen-2-yl)methyl-methyl-[(4-nitro-1,3-dioxoisoindol-2-yl)methyl]azanium Traditional Name: (1,3-diketo-4-nitro-isoindolin-2-yl)methyl-[(6-methoxy-2-naphthyl)methyl]-methyl-ammonium Formula: C22H20N3O5+ MolecularWeight: 406.4113

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)C=C(C=C2)OC)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5/c1-23(12-14-6-7-16-11-17(30-2)9-8-15(16)10-14)13-24-21(26)18-4-3-5-19(25(28)29)20(18)22(24)27/h3-11H,12-13H2,1-2H3/p+1