[2-[(3S)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-1,3-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: [2-[(3S)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-1,3-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[2-[(3S)-3-(4-methoxyphenyl)-5-(2-naphthyl)-1,3-dihydropyrazol-2-yl]-2-oxo-ethyl]ammonium CAS Name: [2-[(3S)-3-(4-methoxyphenyl)-5-(2-naphthalenyl)-1,3-dihydropyrazol-2-yl]-2-oxoethyl]-prop-2-enylammonium IUPAC Name: [2-[(3S)-3-(4-methoxyphenyl)-5-naphthalen-2-yl-1,3-dihydropyrazol-2-yl]-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[2-keto-2-[(5S)-5-(4-methoxyphenyl)-3-(2-naphthyl)-3-pyrazolin-1-yl]ethyl]ammonium Formula: C25H26N3O2+ MolecularWeight: 400.49284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C=C(NN2C(=O)C[NH2+]CC=C)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C=C(NN2C(=O)C[NH2+]CC=C)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H25N3O2/c1-3-14-26-17-25(29)28-24(19-10-12-22(30-2)13-11-19)16-23(27-28)21-9-8-18-6-4-5-7-20(18)15-21/h3-13,15-16,24,26-27H,1,14,17H2,2H3/p+1/t24-/m0/s1