2-methoxy-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-4-prop-2-enyl-phenol

Systemtic Name: 2-methoxy-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-4-prop-2-enyl-phenol Openeye Name: 4-allyl-2-methoxy-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenol CAS Name: 2-methoxy-6-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-4-prop-2-enylphenol IUPAC Name: 2-methoxy-6-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-4-prop-2-enylphenol Traditional Name: 4-allyl-2-methoxy-6-[[4-(4-nitrophenyl)piperazino]methyl]phenol Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])CC=C

Isomeric SMILES

COC1=CC(=CC(=C1O)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])CC=C

InChI

InChI=1S/C21H25N3O4/c1-3-4-16-13-17(21(25)20(14-16)28-2)15-22-9-11-23(12-10-22)18-5-7-19(8-6-18)24(26)27/h3,5-8,13-14,25H,1,4,9-12,15H2,2H3