2-[(Z)-[[4-[(4-iodanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoyl]hydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-[[4-[(4-iodanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoyl]hydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-[[4-(4-iodo-2-methyl-anilino)-4-oxo-butanoyl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[[4-(4-iodo-2-methylanilino)-1,4-dioxobutyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[[4-(4-iodo-2-methylanilino)-4-oxobutanoyl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[[4-(4-iodo-2-methyl-anilino)-4-keto-butanoyl]hydrazono]methyl]-4-nitro-phenolate Formula: C18H16IN4O5- MolecularWeight: 495.24791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CCC(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CCC(=O)N/N=C\C2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H17IN4O5/c1-11-8-13(19)2-4-15(11)21-17(25)6-7-18(26)22-20-10-12-9-14(23(27)28)3-5-16(12)24/h2-5,8-10,24H,6-7H2,1H3,(H,21,25)(H,22,26)/p-1/b20-10-