bis[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: bis[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-bis[2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl]ammonium CAS Name: bis[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-prop-2-enylammonium IUPAC Name: bis[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-bis[2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl]ammonium Formula: C23H28N5O8+ MolecularWeight: 502.49712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C[NH+](CC=C)CC(=O)NC2=CC(=C(C=C2C)[N+](=O)[O-])OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C[NH+](CC=C)CC(=O)NC2=CC(=C(C=C2C)[N+](=O)[O-])OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O8/c1-6-7-26(12-22(29)24-16-10-20(35-4)18(27(31)32)8-14(16)2)13-23(30)25-17-11-21(36-5)19(28(33)34)9-15(17)3/h6,8-11H,1,7,12-13H2,2-5H3,(H,24,29)(H,25,30)/p+1