2-[[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-2-nitro-phenyl]amino]ethylazanium

Systemtic Name: 2-[[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-2-nitro-phenyl]amino]ethylazanium Openeye Name: 2-[4-[(3-chloro-4-methyl-phenyl)carbamoyl]-2-nitro-anilino]ethylammonium CAS Name: 2-[4-[(3-chloro-4-methylanilino)-oxomethyl]-2-nitroanilino]ethylammonium IUPAC Name: 2-[4-[(3-chloro-4-methylphenyl)carbamoyl]-2-nitroanilino]ethylazanium Traditional Name: 2-[4-[(3-chloro-4-methyl-phenyl)carbamoyl]-2-nitro-anilino]ethylammonium Formula: C16H18ClN4O3+ MolecularWeight: 349.79212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC[NH3+])[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCC[NH3+])[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O3/c1-10-2-4-12(9-13(10)17)20-16(22)11-3-5-14(19-7-6-18)15(8-11)21(23)24/h2-5,8-9,19H,6-7,18H2,1H3,(H,20,22)/p+1