cyclopentyl-bis[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopentyl-bis[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopentyl-bis[2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: cyclopentyl-bis[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: cyclopentyl-bis[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]azanium Traditional Name: cyclopentyl-bis[2-keto-2-(4-methoxy-2-nitro-anilino)ethyl]ammonium Formula: C23H28N5O8+ MolecularWeight: 502.49712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C[NH+](CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C[NH+](CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O8/c1-35-16-7-9-18(20(11-16)27(31)32)24-22(29)13-26(15-5-3-4-6-15)14-23(30)25-19-10-8-17(36-2)12-21(19)28(33)34/h7-12,15H,3-6,13-14H2,1-2H3,(H,24,29)(H,25,30)/p+1