(1S)-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: (1S)-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline Openeye Name: (1S)-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline CAS Name: (1S)-2-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline IUPAC Name: (1S)-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline Traditional Name: (1S)-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2CCC3=CC(=C(C=C3[C@@H]2C4=CC=CC=C4)OC)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-15-22(27(28)29)16(2)26(24-15)14-25-11-10-18-12-20(30-3)21(31-4)13-19(18)23(25)17-8-6-5-7-9-17/h5-9,12-13,23H,10-11,14H2,1-4H3/t23-/m0/s1