5-methyl-4-[1-[(2-methylquinolin-6-yl)amino]-3-(4-nitrophenyl)prop-2-enyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-methyl-4-[1-[(2-methylquinolin-6-yl)amino]-3-(4-nitrophenyl)prop-2-enyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-methyl-4-[1-[(2-methyl-6-quinolyl)amino]-3-(4-nitrophenyl)allyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-methyl-4-[1-[(2-methyl-6-quinolinyl)amino]-3-(4-nitrophenyl)prop-2-enyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-methyl-4-[1-[(2-methylquinolin-6-yl)amino]-3-(4-nitrophenyl)prop-2-enyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-methyl-4-[1-[(2-methyl-6-quinolyl)amino]-3-(4-nitrophenyl)allyl]-2-phenyl-2-pyrazolin-3-one Formula: C29H25N5O3 MolecularWeight: 491.5405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC(C=CC3=CC=C(C=C3)[N+](=O)[O-])C4C(=NN(C4=O)C5=CC=CC=C5)C

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC(C=CC3=CC=C(C=C3)[N+](=O)[O-])C4C(=NN(C4=O)C5=CC=CC=C5)C

InChI

InChI=1S/C29H25N5O3/c1-19-8-12-22-18-23(13-17-26(22)30-19)31-27(16-11-21-9-14-25(15-10-21)34(36)37)28-20(2)32-33(29(28)35)24-6-4-3-5-7-24/h3-18,27-28,31H,1-2H3