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

Systemtic Name: (6-methyl-3,4-dihydro-2H-quinolin-1-yl)-[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]methanone Openeye Name: (6-methyl-3,4-dihydro-2H-quinolin-1-yl)-[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]methanone CAS Name: (6-methyl-3,4-dihydro-2H-quinolin-1-yl)-[1-[(2-nitrophenoxy)methyl]-3-pyrazolyl]methanone IUPAC Name: (6-methyl-3,4-dihydro-2H-quinolin-1-yl)-[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]methanone Traditional Name: (6-methyl-3,4-dihydro-2H-quinolin-1-yl)-[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]methanone Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O4/c1-15-8-9-18-16(13-15)5-4-11-24(18)21(26)17-10-12-23(22-17)14-29-20-7-3-2-6-19(20)25(27)28/h2-3,6-10,12-13H,4-5,11,14H2,1H3