(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (2-methyl-4,5,6,7-tetrahydrobenzofuran-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (2-methyl-4,5,6,7-tetrahydrobenzofuran-3-yl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2-methyl-4,5,6,7-tetrahydrobenzofuran-3-yl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)CCCC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(O1)CCCC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4/c1-14-19(17-4-2-3-5-18(17)27-14)20(24)22-12-10-21(11-13-22)15-6-8-16(9-7-15)23(25)26/h6-9H,2-5,10-13H2,1H3