[4-[(4-methyl-3-nitro-phenyl)carbamoyl]phenyl]methylazanium

Systemtic Name: [4-[(4-methyl-3-nitro-phenyl)carbamoyl]phenyl]methylazanium Openeye Name: [4-[(4-methyl-3-nitro-phenyl)carbamoyl]phenyl]methylammonium CAS Name: [4-[(4-methyl-3-nitroanilino)-oxomethyl]phenyl]methylammonium IUPAC Name: [4-[(4-methyl-3-nitrophenyl)carbamoyl]phenyl]methylazanium Traditional Name: [4-[(4-methyl-3-nitro-phenyl)carbamoyl]benzyl]ammonium Formula: C15H16N3O3+ MolecularWeight: 286.30584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O3/c1-10-2-7-13(8-14(10)18(20)21)17-15(19)12-5-3-11(9-16)4-6-12/h2-8H,9,16H2,1H3,(H,17,19)/p+1