ethyl-[3-[(2-methoxy-5-nitro-phenyl)amino]-3-oxidanylidene-propyl]-(2-methylprop-2-enyl)azanium

Systemtic Name: ethyl-[3-[(2-methoxy-5-nitro-phenyl)amino]-3-oxidanylidene-propyl]-(2-methylprop-2-enyl)azanium Openeye Name: ethyl-[3-(2-methoxy-5-nitro-anilino)-3-oxo-propyl]-(2-methylallyl)ammonium CAS Name: ethyl-[3-(2-methoxy-5-nitroanilino)-3-oxopropyl]-(2-methylprop-2-enyl)ammonium IUPAC Name: ethyl-[3-(2-methoxy-5-nitroanilino)-3-oxopropyl]-(2-methylprop-2-enyl)azanium Traditional Name: ethyl-[3-keto-3-(2-methoxy-5-nitro-anilino)propyl]-(2-methylallyl)ammonium Formula: C16H24N3O4+ MolecularWeight: 322.37946

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)CC(=C)C

Isomeric SMILES

CC[NH+](CCC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)CC(=C)C

InChI

InChI=1S/C16H23N3O4/c1-5-18(11-12(2)3)9-8-16(20)17-14-10-13(19(21)22)6-7-15(14)23-4/h6-7,10H,2,5,8-9,11H2,1,3-4H3,(H,17,20)/p+1