1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-[(E)-3-(2-methoxyphenyl)allyl]-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-[(E)-3-(2-methoxyphenyl)allyl]-4-(4-nitrophenyl)piperazin-1-ium Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1/C=C/C[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3/c1-26-20-7-3-2-5-17(20)6-4-12-21-13-15-22(16-14-21)18-8-10-19(11-9-18)23(24)25/h2-11H,12-16H2,1H3/p+1/b6-4+