2-chloranyl-3-[(3-methylphenyl)amino]-1-(4-nitrophenyl)-3-oxidanyl-prop-2-en-1-one

Systemtic Name: 2-chloranyl-3-[(3-methylphenyl)amino]-1-(4-nitrophenyl)-3-oxidanyl-prop-2-en-1-one Openeye Name: 2-chloro-3-hydroxy-3-(3-methylanilino)-1-(4-nitrophenyl)prop-2-en-1-one CAS Name: 2-chloro-3-hydroxy-3-(3-methylanilino)-1-(4-nitrophenyl)-2-propen-1-one IUPAC Name: 2-chloro-3-hydroxy-3-(3-methylanilino)-1-(4-nitrophenyl)prop-2-en-1-one Traditional Name: 2-chloro-3-hydroxy-3-(m-toluidino)-1-(4-nitrophenyl)prop-2-en-1-one Formula: C16H13ClN2O4 MolecularWeight: 332.73842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2O4/c1-10-3-2-4-12(9-10)18-16(21)14(17)15(20)11-5-7-13(8-6-11)19(22)23/h2-9,18,21H,1H3