[(E)-2-nitro-1-[(phenylmethyl)amino]ethenyl]-(phenylmethyl)azanium

Systemtic Name: [(E)-2-nitro-1-[(phenylmethyl)amino]ethenyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(E)-1-(benzylamino)-2-nitro-vinyl]ammonium CAS Name: [(E)-2-nitro-1-[(phenylmethyl)amino]ethenyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(E)-1-(benzylamino)-2-nitroethenyl]azanium Traditional Name: benzyl-[(E)-1-(benzylamino)-2-nitro-vinyl]ammonium Formula: C16H18N3O2+ MolecularWeight: 284.33302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(=C[N+](=O)[O-])NCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]/C(=C/[N+](=O)[O-])/NCC2=CC=CC=C2

InChI

InChI=1S/C16H17N3O2/c20-19(21)13-16(17-11-14-7-3-1-4-8-14)18-12-15-9-5-2-6-10-15/h1-10,13,17-18H,11-12H2/p+1