[5-(azepan-1-yl)-2-[(Z)-2-phenylethenyl]-1,3-oxazol-4-yl]-triphenyl-phosphanium iodide

Systemtic Name: [5-(azepan-1-yl)-2-[(Z)-2-phenylethenyl]-1,3-oxazol-4-yl]-triphenyl-phosphanium iodide Openeye Name: [5-(azepan-1-yl)-2-[(Z)-styryl]oxazol-4-yl]-triphenyl-phosphonium iodide CAS Name: [5-(1-azepanyl)-2-[(Z)-2-phenylethenyl]-4-oxazolyl]-triphenylphosphonium iodide IUPAC Name: [5-(azepan-1-yl)-2-[(Z)-2-phenylethenyl]-1,3-oxazol-4-yl]-triphenylphosphanium iodide Traditional Name: [5-(azepan-1-yl)-2-[(Z)-styryl]oxazol-4-yl]-triphenyl-phosphonium iodide Formula: C35H34IN2OP MolecularWeight: 656.535491

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(N=C(O2)C=CC3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[I-]

Isomeric SMILES

C1CCCN(CC1)C2=C(N=C(O2)/C=C\C3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[I-]

InChI

InChI=1S/C35H34N2OP.HI/c1-2-16-28-37(27-15-1)35-34(36-33(38-35)26-25-29-17-7-3-8-18-29)39(30-19-9-4-10-20-30,31-21-11-5-12-22-31)32-23-13-6-14-24-32;/h3-14,17-26H,1-2,15-16,27-28H2;1H/q+1;/p-1/b26-25-;