[1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

Systemtic Name: [1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazol-3-yl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Openeye Name: [1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazol-3-yl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone CAS Name: [1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone IUPAC Name: [1-[(2-chloro-4-nitrophenoxy)methyl]pyrazol-3-yl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Traditional Name: [1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazol-3-yl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Formula: C21H19ClN4O4 MolecularWeight: 426.85296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H19ClN4O4/c1-14-4-6-19-15(11-14)3-2-9-25(19)21(27)18-8-10-24(23-18)13-30-20-7-5-16(26(28)29)12-17(20)22/h4-8,10-12H,2-3,9,13H2,1H3