3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylpiperazin-1-yl)-3-nitro-phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methyl-1-piperazinyl)-3-nitrophenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylpiperazin-1-yl)-3-nitrophenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-methylpiperazino)-3-nitro-phenyl]methanone Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3/c1-22-10-12-23(13-11-22)19-7-6-17(14-20(19)25(27)28)21(26)24-9-8-16-4-2-3-5-18(16)15-24/h2-7,14H,8-13,15H2,1H3