[3-methyl-4-(7-nitro-4-phenyl-phthalazin-1-yl)piperazin-1-yl]-phenyl-methanone

Systemtic Name: [3-methyl-4-(7-nitro-4-phenyl-phthalazin-1-yl)piperazin-1-yl]-phenyl-methanone Openeye Name: [3-methyl-4-(7-nitro-4-phenyl-phthalazin-1-yl)piperazin-1-yl]-phenyl-methanone CAS Name: [3-methyl-4-(7-nitro-4-phenyl-1-phthalazinyl)-1-piperazinyl]-phenylmethanone IUPAC Name: [3-methyl-4-(7-nitro-4-phenylphthalazin-1-yl)piperazin-1-yl]-phenylmethanone Traditional Name: [3-methyl-4-(7-nitro-4-phenyl-phthalazin-1-yl)piperazino]-phenyl-methanone Formula: C26H23N5O3 MolecularWeight: 453.49252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NN=C(C3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1CN(CCN1C2=NN=C(C3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H23N5O3/c1-18-17-29(26(32)20-10-6-3-7-11-20)14-15-30(18)25-23-16-21(31(33)34)12-13-22(23)24(27-28-25)19-8-4-2-5-9-19/h2-13,16,18H,14-15,17H2,1H3