N-methyl-5-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]quinolin-8-amine

Systemtic Name: N-methyl-5-nitro-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]quinolin-8-amine Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-5-nitro-quinolin-8-amine CAS Name: N-methyl-5-nitro-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-8-quinolinamine IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-5-nitroquinolin-8-amine Traditional Name: (1-benzylpyrazol-4-yl)methyl-methyl-(5-nitro-8-quinolyl)amine Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

InChI

InChI=1S/C21H19N5O2/c1-24(13-17-12-23-25(15-17)14-16-6-3-2-4-7-16)20-10-9-19(26(27)28)18-8-5-11-22-21(18)20/h2-12,15H,13-14H2,1H3