1-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-1-(2-nitramidoethyl)guanidine

Systemtic Name: 1-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-1-(2-nitramidoethyl)guanidine Openeye Name: 1-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-1-(2-nitramidoethyl)guanidine CAS Name: 1-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-(2-nitramidoethyl)guanidine IUPAC Name: 1-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-1-(2-nitramidoethyl)guanidine Traditional Name: 1-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-1-(2-nitramidoethyl)guanidine Formula: C11H16ClN7O4 MolecularWeight: 345.74224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NN(CCN[N+](=O)[O-])C(=N)N)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NN(CCN[N+](=O)[O-])C(=N)N)Cl)N

InChI

InChI=1S/C11H16ClN7O4/c1-23-9-5-8(13)7(12)4-6(9)10(20)17-18(11(14)15)3-2-16-19(21)22/h4-5,16H,2-3,13H2,1H3,(H3,14,15)(H,17,20)