2-[3-(aminomethyl)-4-methoxy-phenyl]-1-nitro-guanidine hydrochloride

Systemtic Name: 2-[3-(aminomethyl)-4-methoxy-phenyl]-1-nitro-guanidine hydrochloride Openeye Name: 2-[3-(aminomethyl)-4-methoxy-phenyl]-1-nitro-guanidine hydrochloride CAS Name: 2-[3-(aminomethyl)-4-methoxyphenyl]-1-nitroguanidine hydrochloride IUPAC Name: 2-[3-(aminomethyl)-4-methoxyphenyl]-1-nitroguanidine hydrochloride Traditional Name: 2-[3-(aminomethyl)-4-methoxy-phenyl]-1-nitro-guanidine hydrochloride Formula: C9H14ClN5O3 MolecularWeight: 275.69216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N=C(N)N[N+](=O)[O-])CN.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N=C(N)N[N+](=O)[O-])CN.Cl

InChI

InChI=1S/C9H13N5O3.ClH/c1-17-8-3-2-7(4-6(8)5-10)12-9(11)13-14(15)16;/h2-4H,5,10H2,1H3,(H3,11,12,13);1H