(4-methoxycarbonyl-2-nitro-phenyl)methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: (4-methoxycarbonyl-2-nitro-phenyl)methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (4-methoxycarbonyl-2-nitro-phenyl)methyl-(p-tolylmethyl)ammonium CAS Name: (4-methoxycarbonyl-2-nitrophenyl)methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (4-methoxycarbonyl-2-nitrophenyl)methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (4-carbomethoxy-2-nitro-benzyl)-(4-methylbenzyl)ammonium Formula: C17H19N2O4+ MolecularWeight: 315.34376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-12-3-5-13(6-4-12)10-18-11-15-8-7-14(17(20)23-2)9-16(15)19(21)22/h3-9,18H,10-11H2,1-2H3/p+1