(5-azanylidene-4-ethoxycarbonyl-1,3-diphenyl-pyrazol-4-yl)methyl-tri(propan-2-yl)phosphanium

Systemtic Name: (5-azanylidene-4-ethoxycarbonyl-1,3-diphenyl-pyrazol-4-yl)methyl-tri(propan-2-yl)phosphanium Openeye Name: (4-ethoxycarbonyl-5-imino-1,3-diphenyl-pyrazol-4-yl)methyl-triisopropyl-phosphonium CAS Name: (4-ethoxycarbonyl-5-imino-1,3-diphenyl-4-pyrazolyl)methyl-tri(propan-2-yl)phosphonium IUPAC Name: (4-ethoxycarbonyl-5-imino-1,3-diphenylpyrazol-4-yl)methyl-tri(propan-2-yl)phosphanium Traditional Name: (4-carbethoxy-5-imino-1,3-diphenyl-2-pyrazolin-4-yl)methyl-triisopropyl-phosphonium Formula: C28H39N3O2P+ MolecularWeight: 480.601921

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=NN(C1=N)C2=CC=CC=C2)C3=CC=CC=C3)C[P+](C(C)C)(C(C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1(C(=NN(C1=N)C2=CC=CC=C2)C3=CC=CC=C3)C[P+](C(C)C)(C(C)C)C(C)C

InChI

InChI=1S/C28H39N3O2P/c1-8-33-27(32)28(19-34(20(2)3,21(4)5)22(6)7)25(23-15-11-9-12-16-23)30-31(26(28)29)24-17-13-10-14-18-24/h9-18,20-22,29H,8,19H2,1-7H3/q+1