2-[4-azanyl-5-[2-[(4-methanoylphenyl)-nitro-amino]phenyl]-5-oxidanylidene-pentyl]guanidine

Systemtic Name: 2-[4-azanyl-5-[2-[(4-methanoylphenyl)-nitro-amino]phenyl]-5-oxidanylidene-pentyl]guanidine Openeye Name: 2-[4-amino-5-[2-(4-formyl-N-nitro-anilino)phenyl]-5-oxo-pentyl]guanidine CAS Name: 2-[4-amino-5-[2-(4-formyl-N-nitroanilino)phenyl]-5-oxopentyl]guanidine IUPAC Name: 2-[4-amino-5-[2-(4-formyl-N-nitroanilino)phenyl]-5-oxopentyl]guanidine Traditional Name: 2-[4-amino-5-[2-(4-formyl-N-nitro-anilino)phenyl]-5-keto-pentyl]guanidine Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N6O4/c20-16(5-3-11-23-19(21)22)18(27)15-4-1-2-6-17(15)24(25(28)29)14-9-7-13(12-26)8-10-14/h1-2,4,6-10,12,16H,3,5,11,20H2,(H4,21,22,23)